mirror of
https://github.com/triqs/dft_tools
synced 2024-07-18 00:43:41 +02:00
40811 lines
1.8 MiB
40811 lines
1.8 MiB
1 18 103 20 4.6431375 # NCDIJ, # of k-points, # of bands, # of proj
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ISITE: 5 R= -0.5000000 0.0000000 0.0000000 PAW projector : dxy
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ISITE: 5 R= -0.5000000 0.0000000 0.0000000 PAW projector : dyz
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ISITE: 5 R= -0.5000000 0.0000000 0.0000000 PAW projector : dz2
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ISITE: 5 R= -0.5000000 0.0000000 0.0000000 PAW projector : dxz
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ISITE: 5 R= -0.5000000 0.0000000 0.0000000 PAW projector : dx2-y2
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ISITE: 6 R= 0.0000000 -0.5000000 -0.5000000 PAW projector : dxy
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ISITE: 6 R= 0.0000000 -0.5000000 -0.5000000 PAW projector : dyz
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ISITE: 6 R= 0.0000000 -0.5000000 -0.5000000 PAW projector : dz2
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ISITE: 6 R= 0.0000000 -0.5000000 -0.5000000 PAW projector : dxz
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ISITE: 6 R= 0.0000000 -0.5000000 -0.5000000 PAW projector : dx2-y2
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ISITE: 7 R= -0.5000000 0.0000000 -0.5000000 PAW projector : dxy
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ISITE: 7 R= -0.5000000 0.0000000 -0.5000000 PAW projector : dyz
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ISITE: 7 R= -0.5000000 0.0000000 -0.5000000 PAW projector : dz2
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ISITE: 7 R= -0.5000000 0.0000000 -0.5000000 PAW projector : dxz
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ISITE: 7 R= -0.5000000 0.0000000 -0.5000000 PAW projector : dx2-y2
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ISITE: 8 R= 0.0000000 -0.5000000 0.0000000 PAW projector : dxy
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ISITE: 8 R= 0.0000000 -0.5000000 0.0000000 PAW projector : dyz
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ISITE: 8 R= 0.0000000 -0.5000000 0.0000000 PAW projector : dz2
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ISITE: 8 R= 0.0000000 -0.5000000 0.0000000 PAW projector : dxz
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ISITE: 8 R= 0.0000000 -0.5000000 0.0000000 PAW projector : dx2-y2
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orbital 1 1 1 -59.9422575665 1.0000000000
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orbital 1 1 2 -59.9420772913 1.0000000000
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orbital 1 1 3 -59.8694181683 1.0000000000
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orbital 1 1 4 -59.8693544118 1.0000000000
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orbital 1 1 5 -59.8225538676 1.0000000000
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orbital 1 1 6 -59.8224191166 1.0000000000
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1 -0.0000001670 -0.0000000176
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14 0.0000001752 0.0000000315
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19 0.0000003082 0.0000001554
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orbital 1 1 7 -59.5654874570 1.0000000000
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3 0.0000000007 0.0000000090
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orbital 1 1 8 -59.5652998144 1.0000000000
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orbital 1 1 9 -59.4939545259 1.0000000000
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orbital 1 1 10 -59.4939415721 1.0000000000
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orbital 1 1 11 -59.4176733871 1.0000000000
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orbital 1 1 73 2.7665068990 1.0000000000
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1 -0.0000502508 -0.0000013344
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2 0.0001167424 0.0000019918
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3 -0.0000039012 0.0000021182
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4 -0.0000185705 -0.0000024070
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5 0.0000076088 -0.0000007785
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6 -0.0000488245 -0.0000023851
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7 0.0001162353 0.0000027564
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8 0.0000007414 0.0000015265
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9 0.0000166093 0.0000031798
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10 -0.0000072904 0.0000004207
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11 0.0000494278 0.0000011489
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12 0.0001258199 0.0000006051
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13 -0.0000048017 -0.0000041924
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14 0.0000007689 -0.0000027019
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15 -0.0000164225 -0.0000012232
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16 0.0000494834 -0.0000003460
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17 0.0001264672 -0.0000007481
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18 0.0000069504 0.0000012774
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19 -0.0000002498 0.0000021840
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20 0.0000157934 0.0000003682
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orbital 1 1 74 2.9855951908 1.0000000000
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1 0.1254544017 0.0762873367
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2 0.2633886220 0.1601637218
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3 0.0435916962 0.0265091528
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4 -0.1520747884 -0.0924749380
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5 -0.2917350536 -0.1774004483
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8 0.0435926957 0.0265090934
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9 -0.1520764052 -0.0924749388
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10 -0.2917346991 -0.1774005908
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12 0.2820066019 0.1714851059
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13 0.0016947127 0.0010292053
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14 -0.0262640348 -0.0159721966
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18 0.0016922304 0.0010280047
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19 -0.0262659686 -0.0159718562
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20 0.1894234887 0.1151865524
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orbital 1 1 75 3.0142630182 1.0000000000
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1 -0.0000019408 0.0000009221
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3 -0.0000052870 -0.0000049409
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5 0.0000023969 -0.0000026835
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7 0.0000010617 0.0000008184
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8 -0.0000037035 -0.0000043650
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9 0.0000078636 -0.0000104053
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17 0.0000023543 -0.0000014118
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18 0.0000084895 0.0000056418
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19 0.0000010194 -0.0000044261
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20 0.0000003737 -0.0000030243
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orbital 1 1 76 3.0212546324 1.0000000000
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1 -0.0000009664 0.0000050424
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2 0.0000020243 0.0000008128
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3 -0.0000069173 0.0000012252
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4 0.0000044287 -0.0000030629
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5 0.0000024474 -0.0000027010
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9 0.0000067070 0.0000047886
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11 0.0000007714 0.0000060727
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12 -0.0000060918 -0.0000045039
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15 -0.0000002152 -0.0000043825
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16 0.0000005125 -0.0000062920
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17 0.0000001935 -0.0000023960
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18 0.0000040224 0.0000001637
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20 -0.0000020585 0.0000014835
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orbital 1 1 77 3.1594051824 1.0000000000
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1 -0.0025823521 0.0697532108
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2 0.0036811489 -0.0994446519
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3 0.0002254728 -0.0060871536
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4 0.0146872835 -0.3967731722
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5 0.0039505735 -0.1067279936
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20 -0.0029053776 0.0784873471
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orbital 1 1 78 3.1728988618 1.0000000000
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1 -0.0000013535 0.0000004952
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2 0.0000013296 0.0000006286
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3 -0.0000006275 0.0000054487
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4 0.0000110889 0.0000181516
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5 0.0000019709 0.0000012535
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7 0.0000036741 -0.0000019159
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13 0.0000006327 0.0000015691
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14 -0.0000105354 -0.0000106509
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15 0.0000013283 0.0000020092
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20 -0.0000027561 -0.0000051147
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orbital 1 1 79 3.2154430622 1.0000000000
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1 0.0690370409 0.0325784766
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2 0.2134394353 0.1007248299
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3 -0.0184166458 -0.0086907307
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4 0.0287377370 0.0135605337
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5 -0.3950471619 -0.1864262606
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6 0.0690374110 0.0325792295
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7 0.2134404898 0.1007250471
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8 0.0184160913 0.0086902395
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9 -0.0287376412 -0.0135610263
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18 0.0034615316 0.0016341073
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20 0.2777259295 0.1310621100
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orbital 1 1 80 3.2659835845 1.0000000000
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1 -0.0263712258 0.0032691615
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2 0.2241859126 -0.0277951654
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3 -0.1184871163 0.0146904699
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4 0.3937038095 -0.0488132240
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5 -0.1022319523 0.0126751858
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6 0.0263709446 -0.0032695500
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9 0.3937039553 -0.0488134412
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20 -0.0143567886 0.0017800379
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orbital 1 1 81 3.6506681559 1.0000000000
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1 0.0027324259 -0.0077276632
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2 -0.0235062707 0.0664812175
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3 -0.0450677926 0.1274658551
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4 -0.1423501621 0.4026107936
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5 0.0167846471 -0.0474711957
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6 0.0027321617 -0.0077273108
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8 0.0450675595 -0.1274658750
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13 0.0458428810 -0.1296577997
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20 -0.0097265211 0.0275086935
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orbital 1 1 82 3.7611498486 1.0000000000
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1 0.0650465114 -0.0286107837
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2 -0.2068513079 0.0909804923
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3 0.1368878683 -0.0602077200
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4 0.1550171548 -0.0681833896
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7 0.2068519267 -0.0909813833
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8 0.1368891743 -0.0602080804
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12 0.3312503507 -0.1456967342
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13 0.1173758441 -0.0516277427
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18 0.1173770017 -0.0516274500
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20 -0.1895744376 0.0833822441
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orbital 1 1 83 3.8223456358 1.0000000000
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1 0.0808514972 -0.0068258831
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2 0.3703896031 -0.0312666968
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3 -0.0385563513 0.0032546699
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4 -0.0625262188 0.0052776990
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5 0.2486680962 -0.0209916445
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7 0.3703894838 -0.0312668158
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14 0.1051074880 -0.0088732550
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20 -0.2210411409 0.0186599675
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orbital 1 1 84 3.9234809527 1.0000000000
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1 0.0191644204 -0.0187996410
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2 0.2256085171 -0.2213221886
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3 -0.0323174231 0.0317017914
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4 -0.0523029628 0.0513103953
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5 0.2553914949 -0.2505393775
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20 -0.1898363627 0.1862300731
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orbital 1 1 85 4.2748549645 1.0037832037
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1 -0.2652175044 -0.3328688786
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2 0.0630270322 0.0791048408
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3 0.0016974055 0.0021315380
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4 -0.0443394133 -0.0556457582
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7 0.0630267253 0.0791026150
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9 0.0443360573 0.0556463143
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20 0.0331272216 0.0415766530
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orbital 1 1 86 4.2971046391 1.0534345603
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1 0.3473029645 0.2395057416
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2 -0.0709355656 -0.0489183384
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3 0.0079719922 0.0054985295
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4 0.0707404466 0.0487837950
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5 0.0351935577 0.0242704155
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6 -0.3473077698 -0.2395112980
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7 0.0709364138 0.0489186254
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8 0.0079712492 0.0054976571
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9 0.0707403435 0.0487846865
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20 -0.0456828755 -0.0315037421
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1 0.0729243679 0.0087052778
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3 -0.3795597420 -0.0453149451
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1 0.0097051931 0.0008741519
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3 0.4390330590 0.0395482018
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4 -0.0894654479 -0.0080568663
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3 -0.2448839267 -0.0960495297
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4 0.1157331449 0.0453932346
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20 -0.0644007852 -0.0252591576
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13 -0.0004006337 0.0000429600
|
|
14 0.0019709926 -0.0002116685
|
|
15 -0.0006170302 0.0000662245
|
|
16 0.0003063720 0.0004197254
|
|
17 0.0006857119 0.0009394735
|
|
18 -0.0002374857 -0.0003254997
|
|
19 0.0011689353 0.0016012420
|
|
20 -0.0003658831 -0.0005012728
|
|
|
|
orbital 1 2 24 -20.6091298383 1.0000000000
|
|
1 0.0006431469 -0.0001181872
|
|
2 0.0005397477 -0.0000992645
|
|
3 -0.0003357771 0.0000616971
|
|
4 0.0022728509 -0.0004177259
|
|
5 0.0008200569 -0.0001507099
|
|
6 0.0004239073 0.0004978616
|
|
7 0.0003557404 0.0004177937
|
|
8 0.0002212687 0.0002598865
|
|
9 -0.0014979584 -0.0017593492
|
|
10 -0.0005405233 -0.0006347431
|
|
11 -0.0008587821 0.0001577797
|
|
12 0.0004023480 -0.0000739393
|
|
13 0.0004218359 -0.0000774826
|
|
14 0.0024780638 -0.0004553328
|
|
15 -0.0007358620 0.0001352118
|
|
16 -0.0005660246 -0.0006648174
|
|
17 0.0002652314 0.0003115157
|
|
18 -0.0002779640 -0.0003265135
|
|
19 -0.0016331331 -0.0019182057
|
|
20 0.0004850316 0.0005695756
|
|
|
|
orbital 1 2 25 -14.2678445634 1.0000000000
|
|
1 0.0000156065 -0.0014824963
|
|
2 -0.0000404441 0.0038636770
|
|
3 0.0000767201 -0.0073131475
|
|
4 -0.0000408548 0.0038879554
|
|
5 -0.0000226931 0.0021606582
|
|
6 -0.0012917272 0.0007277850
|
|
7 0.0033663024 -0.0018967768
|
|
8 0.0063716966 -0.0035901203
|
|
9 -0.0033874296 0.0019086047
|
|
10 -0.0018825429 0.0010606257
|
|
11 0.0000075394 -0.0007107870
|
|
12 0.0000517866 -0.0049411190
|
|
13 0.0000859345 -0.0081931068
|
|
14 0.0000456107 -0.0043454187
|
|
15 -0.0000052896 0.0005013794
|
|
16 -0.0006193151 0.0003488879
|
|
17 -0.0043050399 0.0024256645
|
|
18 0.0071384206 -0.0040221235
|
|
19 0.0037860571 -0.0021332588
|
|
20 -0.0004367987 0.0002460585
|
|
|
|
orbital 1 2 26 -13.5854458482 1.0000000000
|
|
1 0.0128891160 -0.0033474031
|
|
2 -0.0031282231 0.0008122841
|
|
3 0.0286150604 -0.0074310603
|
|
4 -0.0156848472 0.0040732206
|
|
5 -0.0048057605 0.0012480988
|
|
6 0.0093434674 0.0094885314
|
|
7 -0.0022675027 -0.0023029305
|
|
8 -0.0207429028 -0.0210659188
|
|
9 0.0113699273 0.0115469710
|
|
10 0.0034837892 0.0035379170
|
|
11 0.0107228868 -0.0027848034
|
|
12 0.0040434278 -0.0010499816
|
|
13 0.0222720721 -0.0057838656
|
|
14 0.0128220012 -0.0033298253
|
|
15 -0.0041807265 0.0010857647
|
|
16 0.0077731285 0.0078939430
|
|
17 0.0029310245 0.0029767353
|
|
18 -0.0161449532 -0.0163963044
|
|
19 -0.0092945942 -0.0094393404
|
|
20 0.0030305803 0.0030777721
|
|
|
|
orbital 1 2 27 -13.2579062461 1.0000000000
|
|
1 0.0022887649 0.0008501869
|
|
2 0.0013656104 0.0005072436
|
|
3 0.0076764556 0.0028534581
|
|
4 -0.0029677281 -0.0011032915
|
|
5 0.0014282461 0.0005310044
|
|
6 0.0004082321 0.0024071238
|
|
7 0.0002433760 0.0014363166
|
|
8 -0.0013667002 -0.0080748056
|
|
9 0.0005282004 0.0031217239
|
|
10 -0.0002540138 -0.0015024626
|
|
11 -0.0198058083 -0.0073594553
|
|
12 -0.0007802870 -0.0002900650
|
|
13 -0.0394318390 -0.0146532657
|
|
14 -0.0238256826 -0.0088538525
|
|
15 0.0068296888 0.0025376271
|
|
16 -0.0035291436 -0.0208320760
|
|
17 -0.0001390136 -0.0008207857
|
|
18 0.0070255851 0.0414756575
|
|
19 0.0042450048 0.0250606757
|
|
20 -0.0012169712 -0.0071835108
|
|
|
|
orbital 1 2 28 -13.2382155870 1.0000000000
|
|
1 -0.0022092611 0.0016216444
|
|
2 0.0026048526 -0.0019122974
|
|
3 -0.0216196196 0.0158703702
|
|
4 0.0129100473 -0.0094769909
|
|
5 -0.0016836517 0.0012359556
|
|
6 -0.0025090252 -0.0011024355
|
|
7 0.0029583884 0.0012997845
|
|
8 0.0245538839 0.0107881141
|
|
9 -0.0146622238 -0.0064419871
|
|
10 0.0019122244 0.0008401082
|
|
11 0.0029844400 -0.0021911533
|
|
12 -0.0029300642 0.0021512218
|
|
13 -0.0070430164 0.0051712344
|
|
14 -0.0056132971 0.0041211432
|
|
15 -0.0022547150 0.0016553562
|
|
16 0.0033896573 0.0014892734
|
|
17 -0.0033280316 -0.0014619258
|
|
18 0.0079999622 0.0035136415
|
|
19 0.0063757299 0.0028005279
|
|
20 0.0025609134 0.0011250427
|
|
|
|
orbital 1 2 29 -13.1179700072 1.0000000000
|
|
1 -0.0000078940 -0.0000279325
|
|
2 -0.0006328796 -0.0022687816
|
|
3 0.0036465094 0.0130729200
|
|
4 -0.0019110405 -0.0068510951
|
|
5 0.0005157456 0.0018488104
|
|
6 -0.0000198345 0.0000211798
|
|
7 -0.0016482902 0.0016825820
|
|
8 -0.0094985477 0.0096943070
|
|
9 0.0049779283 -0.0050803893
|
|
10 -0.0013431102 0.0013712213
|
|
11 -0.0058972104 -0.0211472109
|
|
12 0.0021731209 0.0077926159
|
|
13 -0.0002556136 -0.0009174286
|
|
14 -0.0005312186 -0.0019053563
|
|
15 0.0030207094 0.0108319917
|
|
16 -0.0153657576 0.0156803735
|
|
17 0.0056620483 -0.0057783140
|
|
18 0.0006671946 -0.0006794922
|
|
19 0.0013847721 -0.0014123430
|
|
20 -0.0078705461 0.0080318787
|
|
|
|
orbital 1 2 30 -13.0476210499 1.0000000000
|
|
1 -0.0117044100 0.0142735812
|
|
2 -0.0036574510 0.0044603734
|
|
3 -0.0046361571 0.0056534897
|
|
4 0.0032426139 -0.0039541790
|
|
5 0.0046325484 -0.0056494685
|
|
6 0.0182133169 0.0030005819
|
|
7 0.0056914674 0.0009376672
|
|
8 -0.0072141392 -0.0011881214
|
|
9 0.0050456558 0.0008310490
|
|
10 0.0072087926 0.0011876793
|
|
11 0.0081865970 -0.0099832332
|
|
12 -0.0001364512 0.0001659780
|
|
13 0.0143182002 -0.0174626283
|
|
14 0.0085110274 -0.0103800506
|
|
15 -0.0027189043 0.0033153848
|
|
16 -0.0127388566 -0.0020993556
|
|
17 0.0002119373 0.0000355894
|
|
18 0.0222821094 0.0036687038
|
|
19 0.0132448740 0.0021809117
|
|
20 -0.0042305752 -0.0006974659
|
|
|
|
orbital 1 2 31 -13.0032151151 1.0000000000
|
|
1 0.0010508732 0.0270885216
|
|
2 0.0003885547 0.0100192059
|
|
3 -0.0003479488 -0.0089971935
|
|
4 0.0000555390 0.0014456030
|
|
5 -0.0005390091 -0.0138981177
|
|
6 -0.0229339786 0.0144543264
|
|
7 -0.0084824930 0.0053462006
|
|
8 -0.0076173621 0.0048006024
|
|
9 0.0012239938 -0.0007712599
|
|
10 -0.0117665566 0.0074159350
|
|
11 -0.0010719699 -0.0276252676
|
|
12 0.0003845582 0.0099118698
|
|
13 0.0001256954 0.0032536652
|
|
14 -0.0000344417 -0.0008777466
|
|
15 0.0005145212 0.0132585984
|
|
16 0.0233880913 -0.0147411711
|
|
17 -0.0083915696 0.0052891023
|
|
18 0.0027546619 -0.0017361815
|
|
19 -0.0007431292 0.0004684071
|
|
20 0.0112249803 -0.0070749740
|
|
|
|
orbital 1 2 32 -12.9200068288 1.0000000000
|
|
1 0.0000919021 -0.0006421821
|
|
2 -0.0008358774 0.0058982291
|
|
3 0.0047162301 -0.0332671991
|
|
4 -0.0025231241 0.0177970819
|
|
5 0.0008013643 -0.0056551982
|
|
6 0.0006022636 -0.0002413550
|
|
7 -0.0055259134 0.0022253789
|
|
8 -0.0311678337 0.0125499115
|
|
9 0.0166739763 -0.0067137765
|
|
10 -0.0052981022 0.0021337759
|
|
11 -0.0007716596 0.0054565624
|
|
12 0.0016291498 -0.0114969885
|
|
13 0.0069349632 -0.0489210801
|
|
14 0.0037816189 -0.0266753584
|
|
15 0.0014176476 -0.0100069211
|
|
16 -0.0051113965 0.0020597756
|
|
17 0.0107711444 -0.0043376259
|
|
18 -0.0458338136 0.0184552620
|
|
19 -0.0249919982 0.0100630040
|
|
20 -0.0093750090 0.0037756631
|
|
|
|
orbital 1 2 33 -12.8806638655 1.0000000000
|
|
1 -0.0244832632 -0.0080337336
|
|
2 -0.0136349622 -0.0044735514
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|
3 0.0323107648 0.0105993966
|
|
4 -0.0152328769 -0.0049969186
|
|
5 0.0153303587 0.0050300355
|
|
6 0.0052858591 0.0252196380
|
|
7 0.0029438680 0.0140448729
|
|
8 0.0069765037 0.0332816678
|
|
9 -0.0032890780 -0.0156905639
|
|
10 0.0033098770 0.0157913793
|
|
11 -0.0032169162 -0.0010564846
|
|
12 0.0086846740 0.0028494142
|
|
13 0.0395429928 0.0129722310
|
|
14 0.0222124508 0.0072867492
|
|
15 0.0061193754 0.0020080501
|
|
16 0.0006951361 0.0033139485
|
|
17 -0.0018754075 -0.0089457944
|
|
18 0.0085380686 0.0407314744
|
|
19 0.0047960365 0.0228800256
|
|
20 0.0013215509 0.0063034184
|
|
|
|
orbital 1 2 34 -12.8239514247 1.0000000000
|
|
1 -0.0088977545 -0.0381373768
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|
2 -0.0026722740 -0.0114546654
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|
3 -0.0017556580 -0.0075215539
|
|
4 0.0018337948 0.0078581888
|
|
5 0.0039105274 0.0167615757
|
|
6 -0.0285788512 0.0267750545
|
|
7 -0.0085838014 0.0080418323
|
|
8 0.0056361278 -0.0052811310
|
|
9 -0.0058885122 0.0055172384
|
|
10 -0.0125605601 0.0117676822
|
|
11 0.0128435310 0.0550515625
|
|
12 -0.0053770977 -0.0230462506
|
|
13 -0.0043554261 -0.0186599943
|
|
14 -0.0013567701 -0.0058107502
|
|
15 -0.0067808258 -0.0290638984
|
|
16 0.0412538926 -0.0386484917
|
|
17 -0.0172699600 0.0161797667
|
|
18 0.0139824901 -0.0131018061
|
|
19 0.0043539906 -0.0040803424
|
|
20 0.0217795140 -0.0204041972
|
|
|
|
orbital 1 2 35 -12.8089191586 1.0000000000
|
|
1 -0.0069191143 -0.0431500654
|
|
2 -0.0022439862 -0.0139965082
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|
3 -0.0001674975 -0.0010335077
|
|
4 0.0007348944 0.0045772429
|
|
5 0.0032182127 0.0200710034
|
|
6 0.0339098980 -0.0275662901
|
|
7 0.0109988046 -0.0089420648
|
|
8 -0.0008147923 0.0006576701
|
|
9 0.0035984587 -0.0029227630
|
|
10 0.0157726185 -0.0128227170
|
|
11 -0.0089248104 -0.0556512272
|
|
12 0.0031790554 0.0198260147
|
|
13 0.0007826190 0.0048937159
|
|
14 -0.0003344239 -0.0020780097
|
|
15 0.0045876753 0.0286080318
|
|
16 0.0437352554 -0.0355527273
|
|
17 -0.0155802069 0.0126664997
|
|
18 0.0038425571 -0.0031296815
|
|
19 -0.0016349087 0.0013256354
|
|
20 0.0224821110 -0.0182766478
|
|
|
|
orbital 1 2 36 -12.7933367893 1.0000000000
|
|
1 0.0075747760 -0.0173507226
|
|
2 -0.0006824393 0.0015609602
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|
3 0.0167066737 -0.0382566019
|
|
4 -0.0095737777 0.0219235665
|
|
5 -0.0013503517 0.0030946191
|
|
6 -0.0188139451 0.0021106750
|
|
7 0.0016929623 -0.0001910472
|
|
8 0.0414846159 -0.0046600664
|
|
9 -0.0237733205 0.0026702660
|
|
10 -0.0033553884 0.0003755707
|
|
11 0.0113679868 -0.0260341663
|
|
12 0.0004339422 -0.0009926411
|
|
13 0.0205878410 -0.0471434877
|
|
14 0.0124104170 -0.0284184904
|
|
15 -0.0032816661 0.0075161127
|
|
16 -0.0282306761 0.0031662766
|
|
17 -0.0010764604 0.0001226755
|
|
18 0.0511213465 -0.0057429619
|
|
19 0.0308163066 -0.0034614631
|
|
20 -0.0081501749 0.0009130224
|
|
|
|
orbital 1 2 37 -2.2260373528 1.0000000000
|
|
1 -0.0144667074 -0.0125926743
|
|
2 0.0307217844 0.0267416510
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|
3 -0.0393040108 -0.0342123105
|
|
4 0.0277092048 0.0241200192
|
|
5 -0.0143104981 -0.0124563343
|
|
6 -0.0036726655 0.0188254976
|
|
7 0.0077986093 -0.0399765196
|
|
8 0.0099773491 -0.0511442697
|
|
9 -0.0070338487 0.0360568112
|
|
10 0.0036322697 -0.0186212008
|
|
11 0.0216993257 0.0188885727
|
|
12 0.0324554803 0.0282512074
|
|
13 0.0410270070 0.0357121851
|
|
14 0.0364208097 0.0317025897
|
|
15 0.0230116758 0.0200306221
|
|
16 0.0055083401 -0.0282363173
|
|
17 0.0082386709 -0.0422328372
|
|
18 -0.0104144720 0.0533864027
|
|
19 -0.0092453338 0.0473923205
|
|
20 -0.0058411904 0.0299440193
|
|
|
|
orbital 1 2 38 -1.8682914464 1.0000000000
|
|
1 0.0069758267 -0.0168008960
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|
2 -0.0164657658 0.0396576545
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|
3 0.0373798507 -0.0900295552
|
|
4 -0.0307543647 0.0740726645
|
|
5 0.0085664484 -0.0206331898
|
|
6 0.0180376317 -0.0023591653
|
|
7 -0.0425779138 0.0055686273
|
|
8 -0.0966574165 0.0126424674
|
|
9 0.0795262170 -0.0104021570
|
|
10 -0.0221518310 0.0028977498
|
|
11 -0.0081513779 0.0196349908
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|
12 -0.0265639623 0.0639786803
|
|
13 -0.0563918331 0.1358209440
|
|
14 -0.0610365202 0.1470088451
|
|
15 -0.0090673060 0.0218385512
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|
16 -0.0210804944 0.0027580020
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|
17 -0.0686893736 0.0089842007
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|
18 0.1458201472 -0.0190731638
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|
19 0.1578318349 -0.0206448118
|
|
20 0.0234464635 -0.0030666442
|
|
|
|
orbital 1 2 39 -1.6545250171 1.0000000000
|
|
1 0.0014582982 -0.0025903070
|
|
2 0.0222037626 -0.0394391712
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|
3 -0.0469975907 0.0834796345
|
|
4 0.0599723328 -0.1065276044
|
|
5 0.0036502837 -0.0064842556
|
|
6 0.0029725501 -0.0000321169
|
|
7 0.0452575098 -0.0004904603
|
|
8 0.0957938729 -0.0010383983
|
|
9 -0.1222419478 0.0013258180
|
|
10 -0.0074407977 0.0000806907
|
|
11 0.0089260772 -0.0158552902
|
|
12 -0.0155017690 0.0275346236
|
|
13 -0.0250578154 0.0445092422
|
|
14 -0.0482284195 0.0856678080
|
|
15 0.0176825470 -0.0314095173
|
|
16 0.0181945040 -0.0001975365
|
|
17 -0.0315963150 0.0003427373
|
|
18 0.0510754863 -0.0005540802
|
|
19 0.0983045468 -0.0010664296
|
|
20 -0.0360427911 0.0003910126
|
|
|
|
orbital 1 2 40 -1.3522098300 1.0000000000
|
|
1 0.0080581055 0.0223765424
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|
2 0.0157557558 0.0437501035
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|
3 -0.0116901568 -0.0324628114
|
|
4 -0.0351575385 -0.0976230455
|
|
5 -0.0109096206 -0.0302941114
|
|
6 0.0153494952 -0.0181665934
|
|
7 0.0300109324 -0.0355200696
|
|
8 0.0222682401 -0.0263554420
|
|
9 0.0669657476 -0.0792588080
|
|
10 0.0207805087 -0.0245951477
|
|
11 0.0090112936 0.0250236898
|
|
12 -0.0193850044 -0.0538280041
|
|
13 -0.0087824595 -0.0243896535
|
|
14 0.0520263619 0.1444626509
|
|
15 -0.0159438910 -0.0442726344
|
|
16 0.0171656694 -0.0203158287
|
|
17 -0.0369237374 0.0437023006
|
|
18 0.0167307734 -0.0198006216
|
|
19 -0.0990958036 0.1172869116
|
|
20 0.0303693454 -0.0359439266
|
|
|
|
orbital 1 2 41 -1.0340537774 1.0000000000
|
|
1 0.0087011605 -0.0055520770
|
|
2 -0.0065214331 0.0041606117
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|
3 -0.0893698676 0.0570335575
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|
4 -0.0649228490 0.0414319896
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|
5 0.0033865537 -0.0021600817
|
|
6 -0.0091601772 -0.0047579372
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|
7 0.0068647265 0.0035659493
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|
8 -0.0940766372 -0.0488807716
|
|
9 -0.0683419812 -0.0355100570
|
|
10 0.0035649285 0.0018517685
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|
11 0.0099886396 -0.0063738985
|
|
12 -0.0149274534 0.0095275200
|
|
13 -0.1905904833 0.1216305422
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|
14 0.0275634032 -0.0175889162
|
|
15 0.0134297226 -0.0085688004
|
|
16 -0.0105161975 -0.0054621700
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|
17 0.0157144746 0.0081649745
|
|
18 -0.2006296380 -0.1042429523
|
|
19 0.0290142232 0.0150765018
|
|
20 0.0141375962 0.0073441290
|
|
|
|
orbital 1 2 42 -1.0107105563 1.0000000000
|
|
1 -0.0573184501 -0.0448571878
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|
2 -0.0175884211 -0.0137599452
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|
3 -0.0035762752 -0.0027988983
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|
4 0.0208599396 0.0163227718
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|
5 -0.0985056678 -0.0770900993
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|
6 0.0101884350 -0.0720671294
|
|
7 0.0031221168 -0.0221115591
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|
8 -0.0006376169 0.0044966225
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|
9 0.0037047539 -0.0262265896
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|
10 -0.0175085418 0.1238527472
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|
11 -0.0741095513 -0.0579971284
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|
12 0.0288454449 0.0225691751
|
|
13 0.0114568480 0.0089655275
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|
14 -0.0145052123 -0.0113489250
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|
15 -0.1366415218 -0.1069363039
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|
16 0.0131730963 -0.0931788599
|
|
17 -0.0051233481 0.0362655717
|
|
18 0.0020323820 -0.0144043832
|
|
19 -0.0025758300 0.0182358520
|
|
20 -0.0242886725 0.1718025808
|
|
|
|
orbital 1 2 43 -0.9454173579 1.0000000000
|
|
1 0.0029454355 0.0053015845
|
|
2 -0.0495220540 -0.0890649812
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|
3 0.0322602783 0.0580151555
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|
4 0.0405590206 0.0729421907
|
|
5 -0.0052619465 -0.0094566033
|
|
6 -0.0031184991 0.0052012964
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|
7 0.0523715232 -0.0874200385
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|
8 0.0341150260 -0.0569443781
|
|
9 0.0428903565 -0.0715957334
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|
10 -0.0055589956 0.0092851421
|
|
11 -0.0018359685 -0.0032981697
|
|
12 0.0726698233 0.1306956375
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|
13 0.0549856686 0.0988843936
|
|
14 -0.0510675751 -0.0918413740
|
|
15 -0.0048943780 -0.0087916138
|
|
16 0.0019377761 -0.0032397978
|
|
17 -0.0768507068 0.1282818341
|
|
18 0.0581452010 -0.0970599307
|
|
19 -0.0540047598 0.0901462212
|
|
20 -0.0051670528 0.0086344180
|
|
|
|
orbital 1 2 44 -0.7454107889 1.0000000000
|
|
1 0.0131451982 0.0108521245
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2 -0.0267106657 -0.0220497122
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3 0.1905459467 0.1573116520
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|
4 -0.1247062857 -0.1029510745
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|
5 -0.0049000570 -0.0040438837
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|
6 0.0028267800 -0.0168092929
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|
7 -0.0057421329 0.0341568102
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|
8 -0.0409606312 0.2436738131
|
|
9 0.0268095666 -0.1594740484
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|
10 0.0010546535 -0.0062651626
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|
11 0.0022594869 0.0018727108
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|
12 -0.0641745633 -0.0529864742
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|
13 -0.1787581180 -0.1475706031
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|
14 -0.1652540764 -0.1364270724
|
|
15 0.0004856577 0.0003966332
|
|
16 0.0004838628 -0.0028940037
|
|
17 -0.0137935442 0.0820707650
|
|
18 0.0384307612 -0.2285932163
|
|
19 0.0355261856 -0.2113282056
|
|
20 -0.0001047850 0.0006181009
|
|
|
|
orbital 1 2 45 -0.7197584780 1.0000000000
|
|
1 0.0171547336 0.0390427787
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2 -0.0184995768 -0.0421053387
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3 -0.0176344091 -0.0401499983
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|
4 -0.0355789458 -0.0809663849
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|
5 -0.0233893347 -0.0532327984
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|
6 -0.0252370681 0.0343757784
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|
7 0.0272142787 -0.0370737258
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|
8 -0.0259446156 0.0353532423
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|
9 -0.0523358401 0.0712907494
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|
10 -0.0344078209 0.0468708395
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|
11 -0.0584697777 -0.1330823178
|
|
12 0.0508985791 0.1158555560
|
|
13 -0.0801353892 -0.1823714024
|
|
14 -0.0253622721 -0.0577109290
|
|
15 0.0426279240 0.0970283576
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|
16 0.0860160303 -0.1171790609
|
|
17 -0.0748803246 0.1020107797
|
|
18 -0.1178784940 0.1605791158
|
|
19 -0.0373058735 0.0508137351
|
|
20 0.0627134464 -0.0854327756
|
|
|
|
orbital 1 2 46 -0.6678638303 1.0000000000
|
|
1 0.0872713527 -0.1159441812
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2 0.0648333474 -0.0861342170
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|
3 0.0114820564 -0.0152499008
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|
4 0.0152854558 -0.0203076756
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|
5 -0.0565554080 0.0751374125
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|
6 -0.1440462767 -0.0176074113
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|
7 -0.1070110197 -0.0130802582
|
|
8 0.0189477512 0.0023176144
|
|
9 0.0252295143 0.0030821715
|
|
10 -0.0933486036 -0.0114110000
|
|
11 0.1306985930 -0.1736386525
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|
12 -0.0906016940 0.1203662239
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|
13 0.0334117089 -0.0443873449
|
|
14 -0.0062954908 0.0083627955
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|
15 -0.0961773924 0.1277752900
|
|
16 -0.2157244325 -0.0263668720
|
|
17 0.1495412799 0.0182786945
|
|
18 0.0551452273 0.0067379946
|
|
19 -0.0103905510 -0.0012719651
|
|
20 -0.1587449611 -0.0194031678
|
|
|
|
orbital 1 2 47 -0.5893990195 1.0000000000
|
|
1 0.0169610944 0.0967779118
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2 0.0174747292 0.0997119119
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3 0.0240520982 0.1372340695
|
|
4 -0.0129527695 -0.0739079855
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|
5 -0.0165702509 -0.0945551115
|
|
6 -0.0753324180 0.0630766272
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|
7 -0.0776160669 0.0649886866
|
|
8 0.1068218519 -0.0894465804
|
|
9 -0.0575299231 0.0481710933
|
|
10 -0.0736026753 0.0616277572
|
|
11 -0.0193429212 -0.1103829400
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|
12 -0.0083005087 -0.0473599909
|
|
13 0.0162291972 0.0926049556
|
|
14 -0.0189334414 -0.1080303525
|
|
15 0.0168475490 0.0961379608
|
|
16 0.0859224411 -0.0719436083
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|
17 0.0368652244 -0.0308680145
|
|
18 0.0720838208 -0.0603582504
|
|
19 -0.0840904508 0.0704122201
|
|
20 0.0748334385 -0.0626598496
|
|
|
|
orbital 1 2 48 -0.4053029660 1.0000000000
|
|
1 -0.0153142550 -0.0037888571
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2 0.0231621804 0.0057346639
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|
3 -0.0368829925 -0.0091300363
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|
4 -0.0205575879 -0.0050882172
|
|
5 -0.1065363701 -0.0263685292
|
|
6 0.0043745268 0.0151574751
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|
7 -0.0066174338 -0.0229260807
|
|
8 -0.0105379907 -0.0365062346
|
|
9 -0.0058717854 -0.0203472340
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|
10 -0.0304323278 -0.1054467589
|
|
11 0.0523277050 0.0129478877
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|
12 -0.0043425539 -0.0010735673
|
|
13 0.0678184183 0.0167859306
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|
14 -0.0180413605 -0.0044649196
|
|
15 0.1142276168 0.0282729870
|
|
16 -0.0149451377 -0.0517934162
|
|
17 0.0012404834 0.0042976123
|
|
18 0.0193738506 0.0671252899
|
|
19 -0.0051520476 -0.0178564462
|
|
20 0.0326306023 0.1130593260
|
|
|
|
orbital 1 2 49 -0.3633469618 1.0000000000
|
|
1 0.0867464399 -0.0396140216
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|
2 0.0885029339 -0.0404164219
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3 -0.1121268418 0.0512051112
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|
4 0.0585905447 -0.0267576751
|
|
5 -0.0443467441 0.0202497712
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|
6 0.0776795506 0.0553172459
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|
7 0.0792531113 0.0564371812
|
|
8 0.1004089964 0.0715018392
|
|
9 -0.0524673120 -0.0373627751
|
|
10 0.0397116553 0.0282790518
|
|
11 -0.2311227956 0.1055487982
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|
12 0.0686491676 -0.0313501968
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|
13 0.1204186427 -0.0549911727
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|
14 0.0825730012 -0.0377097132
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|
15 0.1171728831 -0.0535068748
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|
16 -0.2069683118 -0.1473863626
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|
17 0.0614746247 0.0437770868
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|
18 -0.1078339864 -0.0767896659
|
|
19 -0.0739434963 -0.0526557564
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|
20 -0.1049259023 -0.0747195495
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|
|
|
orbital 1 2 50 -0.0988927119 1.0000000000
|
|
1 -0.0776007134 -0.0115828079
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2 -0.1004589710 -0.0149962011
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3 -0.0275238778 -0.0041089263
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|
4 -0.0104473943 -0.0015599609
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|
5 -0.0004299451 -0.0000645511
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|
6 0.0287663958 0.0729977347
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|
7 0.0372429867 0.0944987096
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|
8 -0.0102044744 -0.0258893624
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|
9 -0.0038729014 -0.0098279178
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|
10 -0.0001600728 -0.0004050508
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|
11 0.2816282473 0.0420414975
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|
12 0.0165011883 0.0024631465
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|
13 -0.0113829471 -0.0016986181
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|
14 0.0103339213 0.0015435978
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|
15 -0.0712732904 -0.0106380926
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|
16 -0.1044053122 -0.2649173892
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|
17 -0.0061187342 -0.0155198362
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|
18 -0.0042187908 -0.0107087188
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|
19 0.0038297964 0.0097217752
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|
20 -0.0264231149 -0.0670421471
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|
|
|
orbital 1 2 51 -0.0642406644 1.0000000000
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|
1 -0.1346805652 -0.1437965822
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2 0.0159658493 0.0170485217
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3 0.0734788550 0.0784557888
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|
4 -0.0069926984 -0.0074679144
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|
5 0.0541336836 0.0577994618
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|
6 0.0571934749 -0.1885335227
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|
7 -0.0067800419 0.0223524462
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|
8 0.0312052363 -0.1028640952
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|
9 -0.0029704552 0.0097894075
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|
10 0.0229887910 -0.0757815901
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|
11 -0.1133412618 -0.1210191167
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|
12 -0.0816416049 -0.0871694242
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|
13 -0.0391518844 -0.0418057394
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|
14 -0.0067775469 -0.0072359810
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|
15 0.0147757317 0.0157745442
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|
16 0.0481318262 -0.1586672898
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|
17 0.0346698436 -0.1142884482
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|
18 -0.0166296060 0.0548111272
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|
19 -0.0028782048 0.0094887100
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|
20 0.0062752731 -0.0206830666
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|
|
|
orbital 1 2 52 0.0521085279 1.0000000000
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|
1 -0.1115354716 -0.1431664941
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2 -0.0178481994 -0.0199311021
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|
3 -0.0857478649 -0.1049497031
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|
4 0.0014447430 0.0029349275
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|
5 0.0338613228 0.0416881246
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|
6 0.0577373789 -0.1710780578
|
|
7 0.0103346328 -0.0248687121
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|
8 -0.0462757126 0.1272161383
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|
9 0.0003515023 -0.0031250439
|
|
10 0.0181823889 -0.0504430053
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|
11 0.0343763594 0.0435113190
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|
12 -0.0381207165 -0.0562433700
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|
13 0.0981683692 0.1195200612
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|
14 0.0151823190 0.0204010104
|
|
15 -0.0120579176 -0.0025783541
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|
16 -0.0180232692 0.0522116152
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|
17 0.0170423796 -0.0646269800
|
|
18 0.0532100824 -0.1451117335
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|
19 0.0075249556 -0.0240559866
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|
20 -0.0109872052 0.0076370609
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|
|
|
orbital 1 2 53 0.0521281386 1.0000000000
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|
1 0.1340080760 0.0816516468
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|
2 -0.0267463964 -0.0138154139
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3 0.0201943769 0.0165673537
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|
4 -0.0191995379 -0.0107998416
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|
5 -0.0119722751 -0.0087696936
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|
6 -0.0087671894 -0.1577453384
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|
7 -0.0004413679 0.0299423746
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|
8 0.0050902367 0.0264199668
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|
9 -0.0004612077 -0.0220420239
|
|
10 -0.0020907879 -0.0150096750
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|
11 -0.0313210955 -0.0196032690
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|
12 0.1640882096 0.0938915816
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|
13 -0.0129192386 -0.0132764080
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|
14 -0.0329790820 -0.0193360018
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|
15 -0.1941370996 -0.1075546100
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|
16 0.0025002123 0.0371907650
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|
17 -0.0053560026 -0.1893710599
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|
18 -0.0056236912 -0.0185658106
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|
19 -0.0014874106 -0.0383493587
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|
20 -0.0032110228 -0.2218558763
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|
|
|
orbital 1 2 54 0.1284674788 1.0000000000
|
|
1 -0.0806098528 0.0340198664
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2 0.0061419424 -0.0025916154
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3 -0.0075978618 0.0032083037
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|
4 0.0031224030 -0.0013187467
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|
5 0.1518549506 -0.0640831393
|
|
6 0.0697664716 0.0528001566
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|
7 -0.0053159039 -0.0040232485
|
|
8 -0.0065767769 -0.0049768542
|
|
9 0.0027028353 0.0020449609
|
|
10 0.1314253302 0.0994685223
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|
11 -0.1119860398 0.0472543824
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|
12 -0.1038116910 0.0438122416
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|
13 0.0199588101 -0.0084240930
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|
14 -0.0023137487 0.0009747333
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|
15 -0.0668896054 0.0282247861
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|
16 0.0969175056 0.0733546827
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|
17 0.0898476526 0.0679974739
|
|
18 0.0172737605 0.0130737245
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|
19 -0.0020007794 -0.0015160170
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|
20 -0.0578879685 -0.0438161970
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|
|
|
orbital 1 2 55 0.4162670423 1.0000000000
|
|
1 -0.2241278800 0.0758718190
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|
2 -0.0865519718 0.0292996625
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3 0.0483026132 -0.0163512947
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|
4 0.0141947011 -0.0048056040
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|
5 -0.0427656231 0.0144773024
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|
6 0.1777701436 0.1561647716
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|
7 0.0686505853 0.0603060866
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|
8 0.0383120504 0.0336556736
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|
9 0.0112594228 0.0098897333
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|
10 -0.0339212046 -0.0297977040
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|
11 -0.0386429962 0.0130815393
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|
12 0.0777003882 -0.0263041086
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|
13 0.0494552450 -0.0167429253
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|
14 -0.0435828269 0.0147530460
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|
15 -0.0386620541 0.0130867966
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|
16 0.0306502792 0.0269247818
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|
17 -0.0616302244 -0.0541383002
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|
18 0.0392269426 0.0344591465
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|
19 -0.0345681778 -0.0303667717
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|
20 -0.0306637777 -0.0269382121
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|
|
|
orbital 1 2 56 0.8155183473 1.0000000000
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|
1 -0.0448744525 -0.1283114854
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|
2 0.0668148703 0.1910467735
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3 -0.0062082492 -0.0177494483
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|
4 -0.0140581813 -0.0401962906
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|
5 0.0535767942 0.1531965919
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|
6 -0.0886849157 0.1030179647
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|
7 0.1320454043 -0.1533863844
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|
8 0.0122680736 -0.0142526816
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|
9 0.0277835297 -0.0322724695
|
|
10 -0.1058829883 0.1229953509
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|
11 0.0405010842 0.1158112520
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|
12 0.0546753955 0.1563384077
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|
13 -0.0184600487 -0.0527839459
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|
14 -0.0142852514 -0.0408462162
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|
15 -0.0177552505 -0.0507637839
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|
16 0.0800433865 -0.0929809730
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|
17 0.1080564633 -0.1255199996
|
|
18 0.0364817064 -0.0423795762
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|
19 0.0282318480 -0.0327945124
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|
20 0.0350875491 -0.0407577594
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|
|
|
orbital 1 2 57 1.0513504380 1.0000000000
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|
1 0.0234294407 -0.0601391909
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|
2 -0.0344456053 0.0884038907
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3 -0.0444212259 0.1140179673
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|
4 0.0009780794 -0.0025170656
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|
5 -0.0716714813 0.1839496777
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|
6 0.0637972759 -0.0097784696
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|
7 -0.0937858851 0.0143687825
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|
8 0.1209517470 -0.0185382618
|
|
9 -0.0026716165 0.0004104760
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|
10 0.1951413412 -0.0299049636
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|
11 0.0284527331 -0.0730270977
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|
12 -0.0578889724 0.1485753122
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|
13 0.0171453504 -0.0440089189
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|
14 0.0056076634 -0.0143912359
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|
15 0.0419105088 -0.1075635254
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|
16 0.0774716447 -0.0118743095
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|
17 -0.1576150283 0.0241541467
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|
18 -0.0466836430 0.0071540564
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|
19 -0.0152650071 0.0023413404
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|
20 -0.1141109456 0.0174865150
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|
|
|
orbital 1 2 58 1.0816862601 1.0000000000
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|
1 -0.1068118834 -0.0547475242
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2 -0.1293509258 -0.0663027177
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|
3 0.0526640048 0.0269957492
|
|
4 0.0032109411 0.0016459329
|
|
5 -0.0043852328 -0.0022479054
|
|
6 -0.0059924395 -0.1198754290
|
|
7 -0.0072552596 -0.1451721631
|
|
8 -0.0029554118 -0.0591046634
|
|
9 -0.0001802266 -0.0036064918
|
|
10 0.0002456283 0.0049202099
|
|
11 -0.0389759613 -0.0199766882
|
|
12 0.0011012596 0.0005623016
|
|
13 0.1270283859 0.0651123373
|
|
14 -0.0206387234 -0.0105790189
|
|
15 0.1204263131 0.0617286556
|
|
16 -0.0021866520 -0.0437427707
|
|
17 0.0000621010 0.0012338631
|
|
18 -0.0071255643 -0.1425664256
|
|
19 0.0011569968 0.0231619685
|
|
20 -0.0067522088 -0.1351543955
|
|
|
|
orbital 1 2 59 1.3561556294 1.0000000000
|
|
1 -0.0751933214 -0.0369319922
|
|
2 0.1552541534 0.0762541060
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3 0.1162231110 0.0570827256
|
|
4 -0.0513517818 -0.0252215452
|
|
5 0.0246838679 0.0121228255
|
|
6 0.0056135640 0.0835842022
|
|
7 -0.0115888495 -0.1725815606
|
|
8 0.0086757376 0.1291935209
|
|
9 -0.0038339267 -0.0570816199
|
|
10 0.0018434325 0.0274388475
|
|
11 -0.0343680261 -0.0168790941
|
|
12 -0.1142580960 -0.0561178083
|
|
13 0.1133696865 0.0556820696
|
|
14 0.0047525323 0.0023335242
|
|
15 -0.0348409377 -0.0171129440
|
|
16 0.0025660642 0.0382026132
|
|
17 0.0085292082 0.1270094346
|
|
18 0.0084646070 0.1260216937
|
|
19 0.0003542710 0.0052814160
|
|
20 -0.0026000400 -0.0387290167
|
|
|
|
orbital 1 2 60 1.4481429130 1.0000000000
|
|
1 0.0407773808 -0.0851067407
|
|
2 -0.0247836007 0.0517250874
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3 0.0377505610 -0.0787916918
|
|
4 -0.0229370987 0.0478727801
|
|
5 0.0615000397 -0.1283522911
|
|
6 -0.0940899085 0.0072411929
|
|
7 0.0571841777 -0.0043997004
|
|
8 0.0871087980 -0.0067052024
|
|
9 -0.0529292469 0.0040704774
|
|
10 0.1419094010 -0.0109149017
|
|
11 0.0293818569 -0.0613246834
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|
12 0.0123435539 -0.0257627115
|
|
13 0.0275229307 -0.0574478818
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|
14 0.0251941251 -0.0525816693
|
|
15 0.0561777305 -0.1172475378
|
|
16 -0.0677989174 0.0052163488
|
|
17 -0.0284828966 0.0021890268
|
|
18 0.0635154518 -0.0048836256
|
|
19 0.0581316933 -0.0044753692
|
|
20 0.1296279642 -0.0099723122
|
|
|
|
orbital 1 2 61 1.4653653483 1.0000000000
|
|
1 -0.0804385898 0.0559045442
|
|
2 0.0989627492 -0.0687778703
|
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3 -0.1156916899 0.0804056678
|
|
4 -0.1420233952 0.0987065726
|
|
5 0.0246285227 -0.0171177166
|
|
6 -0.0886358632 -0.0417092037
|
|
7 0.1090455546 0.0513130956
|
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8 0.1274805743 0.0599883240
|
|
9 0.1564932399 0.0736424089
|
|
10 -0.0271360691 -0.0127717045
|
|
11 0.0869090835 -0.0604039171
|
|
12 0.0913800037 -0.0635099756
|
|
13 0.1150488748 -0.0799611172
|
|
14 -0.1557105239 0.1082185126
|
|
15 0.0003324431 -0.0002337077
|
|
16 0.0957647973 0.0450650590
|
|
17 0.1006903261 0.0473837567
|
|
18 -0.1267716349 -0.0596539827
|
|
19 0.1715769932 0.0807405427
|
|
20 -0.0003664110 -0.0001729277
|
|
|
|
orbital 1 2 62 1.5578199143 1.0000000000
|
|
1 0.1213415463 0.1202260150
|
|
2 -0.0310266363 -0.0307421794
|
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3 0.0460311716 0.0456091349
|
|
4 -0.0436492893 -0.0432481193
|
|
5 0.0764217440 0.0757179375
|
|
6 -0.0434479565 0.1651988753
|
|
7 0.0111094384 -0.0422387506
|
|
8 0.0164817423 -0.0626692424
|
|
9 -0.0156284658 0.0594245868
|
|
10 0.0273624908 -0.1040430756
|
|
11 -0.0303055276 -0.0300251752
|
|
12 -0.0152598235 -0.0151194202
|
|
13 0.0964711933 0.0955849441
|
|
14 -0.0399695440 -0.0396015537
|
|
15 -0.0635913316 -0.0630056707
|
|
16 0.0108498226 -0.0412566220
|
|
17 0.0054639944 -0.0207742006
|
|
18 0.0345437561 -0.1313398009
|
|
19 -0.0143102150 0.0544147650
|
|
20 -0.0227701431 0.0865737514
|
|
|
|
orbital 1 2 63 1.6582658308 1.0000000000
|
|
1 0.0648483107 -0.0445082723
|
|
2 0.0166594088 -0.0114318965
|
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3 -0.0701192160 0.0481251367
|
|
4 -0.0737845151 0.0506387881
|
|
5 0.0437805887 -0.0300482384
|
|
6 0.0709694098 0.0339049047
|
|
7 0.0182300355 0.0087117633
|
|
8 0.0767376223 0.0366635633
|
|
9 0.0807472695 0.0385791118
|
|
10 -0.0479130842 -0.0228911354
|
|
11 -0.0817710603 0.0561221727
|
|
12 -0.1037982031 0.0712397191
|
|
13 0.0539829916 -0.0370496998
|
|
14 -0.0740476739 0.0508207916
|
|
15 -0.0978774976 0.0671759937
|
|
16 -0.0894870530 -0.0427547622
|
|
17 -0.1135952720 -0.0542723813
|
|
18 -0.0590780269 -0.0282271472
|
|
19 0.0810348121 0.0387163421
|
|
20 0.1071160618 0.0511775544
|
|
|
|
orbital 1 2 64 1.7334210086 1.0000000000
|
|
1 0.0006506453 0.0000719784
|
|
2 -0.1306019927 -0.0149989391
|
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3 -0.2060518853 -0.0236667700
|
|
4 -0.0427594944 -0.0049107945
|
|
5 0.0633328329 0.0072724574
|
|
6 0.0002630938 0.0006032266
|
|
7 -0.0523114849 -0.1206064974
|
|
8 0.0825303533 0.1902764229
|
|
9 0.0171259358 0.0394884711
|
|
10 -0.0253666561 -0.0584852034
|
|
11 -0.1193682214 -0.0137089159
|
|
12 0.0116133210 0.0013339270
|
|
13 -0.0321060131 -0.0036879883
|
|
14 -0.0785405063 -0.0090191514
|
|
15 -0.0690422950 -0.0079296732
|
|
16 -0.0478104174 -0.1102266488
|
|
17 0.0046502190 0.0107217591
|
|
18 0.0128601789 0.0296505293
|
|
19 0.0314595581 0.0725296346
|
|
20 0.0276554627 0.0637571833
|
|
|
|
orbital 1 2 65 1.8599724370 1.0000000000
|
|
1 0.0025957273 -0.0001175607
|
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2 0.0227332861 -0.0010552377
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3 -0.0018893799 0.0000893683
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|
4 -0.0362314565 0.0016834938
|
|
5 -0.0877066795 0.0040823457
|
|
6 -0.0014024412 -0.0021894878
|
|
7 -0.0122814432 -0.0191576106
|
|
8 -0.0010195952 -0.0015901029
|
|
9 -0.0195732208 -0.0305347253
|
|
10 -0.0473895217 -0.0739176673
|
|
11 -0.0203482949 0.0009476603
|
|
12 -0.0231513285 0.0010803557
|
|
13 -0.0081186717 0.0003809358
|
|
14 0.0423255936 -0.0019706307
|
|
15 -0.0744692653 0.0034663887
|
|
16 0.0109937854 0.0171473241
|
|
17 0.0125116732 0.0195117614
|
|
18 -0.0043877079 -0.0068421419
|
|
19 0.0228694127 0.0356678306
|
|
20 -0.0402360686 -0.0627574135
|
|
|
|
orbital 1 2 66 1.8834369017 1.0000000000
|
|
1 0.0301911153 0.0610348469
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|
2 0.0578276089 0.1169048145
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3 -0.0434688925 -0.0878724779
|
|
4 -0.0672019723 -0.1358442453
|
|
5 -0.0273006180 -0.0551862017
|
|
6 0.0377602673 -0.0566650963
|
|
7 0.0723235175 -0.1085328536
|
|
8 0.0543658578 -0.0815809265
|
|
9 0.0840467700 -0.1261189147
|
|
10 0.0341450138 -0.0512335829
|
|
11 -0.0229262498 -0.0463458353
|
|
12 0.0480618452 0.0971612619
|
|
13 0.0537617830 0.1086844112
|
|
14 -0.0692156312 -0.1399157172
|
|
15 0.0286360107 0.0578838895
|
|
16 -0.0286776123 0.0430277211
|
|
17 0.0601089419 -0.0902038593
|
|
18 -0.0672402686 0.1009026805
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|
19 0.0865629066 -0.1298990323
|
|
20 -0.0358135536 0.0537421693
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|
|
|
orbital 1 2 67 2.1590908547 1.0000000000
|
|
1 0.0164385128 -0.0308225053
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2 0.0238921511 -0.0448058771
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3 0.0276759955 -0.0519024254
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|
4 0.0111621054 -0.0209405427
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|
5 -0.0092486617 0.0173465563
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|
6 0.0349126883 -0.0011764024
|
|
7 0.0507506481 -0.0017063280
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|
8 -0.0587881459 0.0019794019
|
|
9 -0.0237157135 0.0007940506
|
|
10 0.0196472235 -0.0006603673
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|
11 0.0163537734 -0.0306633809
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|
12 0.0192610577 -0.0361168303
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|
13 0.0335643530 -0.0629303549
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|
14 -0.0099529251 0.0186632983
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|
15 -0.0149567265 0.0280476440
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|
16 0.0347322067 -0.0011703625
|
|
17 0.0409074805 -0.0013775275
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|
18 -0.0712796224 0.0024072784
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|
19 0.0211391617 -0.0007159954
|
|
20 0.0317701021 -0.0010702096
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|
|
|
orbital 1 2 68 2.1932426129 1.0000000000
|
|
1 0.0338768671 0.0294457456
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2 -0.0504781252 -0.0438771007
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3 0.0630740192 0.0548258560
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|
4 -0.1184166863 -0.1029340281
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|
5 0.0492572436 0.0428149570
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6 0.0085614243 -0.0440577736
|
|
7 -0.0127612428 0.0656524127
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|
8 -0.0159392123 0.0820357241
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|
9 0.0299366658 -0.1540207395
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|
10 -0.0124531772 0.0640650092
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|
11 0.0531209410 0.0461776335
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|
12 0.0260012693 0.0226024687
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|
13 0.1195434372 0.1039156367
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|
14 0.0176450750 0.0153362309
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|
15 0.0117038134 0.0101733047
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|
16 0.0134249089 -0.0690923076
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|
17 0.0065716962 -0.0338219162
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|
18 -0.0302206448 0.1554851405
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|
19 -0.0044607836 0.0229496961
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|
20 -0.0029574869 0.0152201852
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|
|
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orbital 1 2 69 2.2087432442 1.0000000000
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|
1 -0.0144622363 0.0293655588
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2 0.0520856245 -0.1057824025
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3 -0.0281111481 0.0570585817
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|
4 -0.0139046460 0.0282134445
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|
5 -0.0017054635 0.0034710805
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|
6 -0.0326623466 0.0021566981
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|
7 0.1176534430 -0.0077738226
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|
8 0.0634714002 -0.0042110371
|
|
9 0.0313869390 -0.0020881419
|
|
10 0.0038582804 -0.0002507780
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|
11 -0.0002012442 0.0004141409
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|
12 0.0413640262 -0.0840066651
|
|
13 -0.0002881266 0.0006052600
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|
14 0.0019666990 -0.0040207091
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|
15 -0.0189128033 0.0384057196
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|
16 -0.0004600870 0.0000300741
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|
17 0.0934325076 -0.0061734414
|
|
18 0.0006668120 -0.0000349719
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|
19 -0.0044652340 0.0002814721
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|
20 0.0427167335 -0.0028286499
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|
|
|
orbital 1 2 70 2.2135903112 1.0000000000
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|
1 0.0148936915 -0.0052034245
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2 0.0838088384 -0.0292830367
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3 0.2595253127 -0.0906612231
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|
4 0.1741946989 -0.0608509810
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|
5 -0.0715851549 0.0250045840
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|
6 -0.0119543688 -0.0102966561
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|
7 -0.0672568613 -0.0579492987
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|
8 0.2082807407 0.1794199828
|
|
9 0.1397987365 0.1204271712
|
|
10 -0.0574516540 -0.0494895576
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|
11 0.0030825542 -0.0010793680
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|
12 0.0920380904 -0.0321568253
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|
13 -0.1580124777 0.0551970648
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|
14 0.2596257225 -0.0907002905
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|
15 0.0686665132 -0.0239891673
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|
16 -0.0024743449 -0.0021332804
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|
17 -0.0738608350 -0.0636349626
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|
18 -0.1268073491 -0.1092425521
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|
19 0.2083608832 0.1794919067
|
|
20 0.0551097903 0.0474723624
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|
|
|
orbital 1 2 71 2.5236071937 1.0000000000
|
|
1 0.0030197660 -0.0199352328
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2 0.0107393393 -0.0708205016
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3 -0.0014196030 0.0093519478
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|
4 -0.0129741674 0.0855232789
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|
5 -0.0297073272 0.1958468345
|
|
6 0.0187771178 -0.0073475218
|
|
7 0.0667003758 -0.0261095770
|
|
8 0.0088039587 -0.0034443988
|
|
9 0.0805527648 -0.0315253896
|
|
10 0.1844616104 -0.0722026177
|
|
11 -0.0001835527 0.0011731535
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|
12 -0.0090134558 0.0594124035
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|
13 -0.0014928819 0.0098188348
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|
14 0.0116315762 -0.0766766651
|
|
15 -0.0305003354 0.2010808359
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|
16 -0.0010999455 0.0004326120
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|
17 -0.0559591683 0.0219000107
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|
18 0.0092584960 -0.0036203924
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|
19 -0.0722157702 0.0282685105
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|
20 0.1893880074 -0.0741307655
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|
|
|
orbital 1 2 72 2.5842516880 1.0000000000
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|
1 -0.0729229468 0.0050172220
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2 0.0028004287 -0.0001928148
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3 -0.0072849292 0.0005032308
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|
4 0.0043296441 -0.0002969133
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|
5 -0.1279027063 0.0088024017
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|
6 0.0408084719 0.0606485826
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|
7 -0.0015691111 -0.0023274361
|
|
8 -0.0040773862 -0.0060549248
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|
9 0.0024264240 0.0036029492
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|
10 -0.0715788573 -0.1063672600
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|
11 -0.0656471094 0.0045154649
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|
12 -0.0090145742 0.0006184757
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|
13 0.0020517694 -0.0001428469
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|
14 -0.0045670812 0.0003150023
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|
15 -0.1302615670 0.0089636303
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|
16 0.0367379633 0.0545888416
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|
17 0.0050449723 0.0074946917
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|
18 0.0011520976 0.0017046649
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|
19 -0.0025553415 -0.0038012835
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|
20 -0.0728975117 -0.1083284907
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|
|
|
orbital 1 2 73 3.0775540813 1.0000000000
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1 -0.1462738170 -0.0737262710
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2 -0.0793461788 -0.0399941823
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|
3 0.0058739335 0.0029592472
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|
4 -0.2813546745 -0.1418108598
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|
5 -0.2033371035 -0.1024885110
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|
6 0.0092874992 0.1635405570
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|
7 0.0050385119 0.0887135846
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|
8 0.0003732313 0.0065647454
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|
9 -0.0178659714 -0.3145665988
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|
10 -0.0129111425 -0.2273387244
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|
11 -0.1468916486 -0.0740380628
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|
12 0.0627554436 0.0316304696
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|
13 0.0006248614 0.0003163351
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|
14 0.2551452048 0.1286013874
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|
15 -0.2344665979 -0.1181785351
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|
16 0.0093263404 0.1642334945
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|
17 -0.0039851489 -0.0701629373
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|
18 0.0000388458 0.0006999414
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|
19 0.0162020307 0.2852636468
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|
20 -0.0148882188 -0.2621435542
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|
|
|
orbital 1 2 74 3.1583694297 1.0000000000
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1 0.1052054568 -0.0192103394
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2 -0.2289297013 0.0418014840
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3 -0.0469951337 0.0085822398
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|
4 0.2335147134 -0.0426390907
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|
5 -0.0106322476 0.0019409844
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|
6 0.0692372312 0.0815050861
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|
7 -0.1506667603 -0.1773581827
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|
8 0.0309316816 0.0364094688
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|
9 -0.1536846290 -0.1809093188
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|
10 0.0069982057 0.0082376219
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|
11 -0.1015942526 0.0185520917
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|
12 -0.4045150273 0.0738648026
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|
13 0.0769534949 -0.0140524415
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|
14 -0.1587240399 0.0289870902
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|
15 0.0125831155 -0.0022987598
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|
16 -0.0668654499 -0.0787075234
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|
17 -0.2662267796 -0.3133882242
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|
18 -0.0506470896 -0.0596177401
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|
19 0.1044665420 0.1229676481
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|
20 -0.0082807106 -0.0097469550
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|
|
|
orbital 1 2 75 3.2021712238 1.0000000000
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|
1 0.0543291668 -0.0217713342
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|
2 -0.2887761061 0.1157270693
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3 -0.0257419903 0.0103157553
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|
4 -0.3225164278 0.1292521702
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|
5 0.0007561217 -0.0003016185
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|
6 0.0460187494 0.0361640753
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|
7 -0.2446106704 -0.1922231980
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|
8 0.0218058907 0.0171346237
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|
9 0.2731950386 0.2146811320
|
|
10 -0.0006398373 -0.0005038532
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|
11 -0.0461997183 0.0185140134
|
|
12 -0.0545748312 0.0218694242
|
|
13 -0.0036672197 0.0014709492
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|
14 0.3680417511 -0.1474934996
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|
15 0.0108870332 -0.0043630579
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|
16 -0.0391342633 -0.0307531111
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|
17 -0.0462270216 -0.0363284206
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|
18 0.0031054320 0.0024414272
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|
19 -0.3117547572 -0.2449853894
|
|
20 -0.0092223258 -0.0072463776
|
|
|
|
orbital 1 2 76 3.2694245835 1.0000000000
|
|
1 0.1716327814 -0.0557989988
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2 0.0442012501 -0.0143711783
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3 -0.0431493977 0.0140284597
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|
4 0.0821876532 -0.0267214415
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|
5 0.3072663728 -0.0998959680
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6 0.1341391987 0.1207365748
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7 0.0345477187 0.0310940587
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8 0.0337251221 0.0303545488
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|
9 -0.0642368999 -0.0578184178
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10 -0.2401457091 -0.2161511018
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|
11 -0.1874150418 0.0609327313
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|
12 0.0532286216 -0.0173076093
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|
13 0.0360827181 -0.0117279985
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|
14 0.0811903497 -0.0263954229
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|
15 -0.3324479877 0.1080855368
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|
16 -0.1464791863 -0.1318405239
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|
17 0.0416041388 0.0374441311
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|
18 -0.0282012393 -0.0253814120
|
|
19 -0.0634569659 -0.0571150290
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|
20 0.2598289587 0.2338670989
|
|
|
|
orbital 1 2 77 3.3695763357 1.0000000000
|
|
1 -0.0060018351 0.0407160142
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2 0.0407647265 -0.2764466331
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3 0.0215953628 -0.1464298663
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4 0.0055745868 -0.0377669138
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|
5 -0.0103758692 0.0703732255
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6 0.0382656442 -0.0151568218
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7 -0.2597890855 0.1029182343
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8 0.1376099736 -0.0545142793
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|
9 0.0354914198 -0.0140589096
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10 -0.0661371839 0.0262012171
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|
11 0.0116553249 -0.0790369169
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12 0.0458774724 -0.3111293696
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13 -0.0207494528 0.1407155465
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14 0.0157057904 -0.1064768367
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15 0.0165104980 -0.1119638762
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|
16 -0.0742766778 0.0294272529
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|
17 -0.2923832340 0.1158324313
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|
18 -0.1322401034 0.0523893537
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19 0.1000617164 -0.0396363778
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20 0.1052197948 -0.0416858168
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|
|
|
orbital 1 2 78 3.4839827823 1.0000000000
|
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1 -0.0561318799 -0.1080067909
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2 0.0463587666 0.0891963759
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3 0.0001809610 0.0003492478
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4 0.1710068962 0.3290448544
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5 -0.0815969625 -0.1570026519
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6 -0.0654709903 0.1026175948
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7 0.0540690882 -0.0847456181
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8 -0.0002092277 0.0003287070
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9 -0.1994553155 0.3126165756
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10 0.0951693195 -0.1491674388
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11 -0.0544308637 -0.1047327429
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12 -0.0318023013 -0.0611936229
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13 -0.0304654719 -0.0586214319
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14 -0.0985816441 -0.1896791152
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15 -0.1109678859 -0.2135140574
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17 -0.0370935561 0.0581378499
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|
18 0.0355345017 -0.0556974626
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|
19 0.1149756412 -0.1802145974
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20 0.1294273307 -0.2028574856
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|
|
|
orbital 1 2 79 3.5267542548 1.0000000000
|
|
1 -0.0107921218 -0.0553476251
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2 0.0320360596 0.1642675351
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3 -0.0156680338 -0.0803554575
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|
4 -0.0332629477 -0.1705973239
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|
5 -0.0468363387 -0.2401788767
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6 -0.0425342860 0.0370228229
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|
7 0.1262421578 -0.1098773240
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8 0.0617542974 -0.0537466536
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|
9 0.1311075605 -0.1141038349
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10 0.1845785358 -0.1606525971
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|
11 0.0036386720 0.0186530654
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|
12 0.0350288110 0.1796260898
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|
13 0.0171998683 0.0882059535
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|
14 -0.0542684743 -0.2782961252
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|
15 0.0202838345 0.1040107394
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|
16 0.0143372228 -0.0124743953
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|
17 0.1380466852 -0.1201511508
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|
18 -0.0677888046 0.0589982244
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19 0.2138777603 -0.1861464545
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|
20 -0.0799369854 0.0695697013
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|
|
|
orbital 1 2 80 3.6350781207 1.0000000000
|
|
1 0.0122991539 -0.1500874579
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2 0.0065739375 -0.0802163867
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3 -0.0016016912 0.0195180425
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|
4 -0.0041157632 0.0502046675
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|
5 0.0336591652 -0.4106870959
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6 0.1361288407 -0.0643909147
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7 0.0727566734 -0.0344122157
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8 0.0177001529 -0.0083739165
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|
9 0.0455360628 -0.0215378874
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|
10 -0.3724925027 0.1761950456
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11 0.0100051917 -0.1220853944
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12 -0.0051182873 0.0624361224
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|
13 -0.0009288746 0.0113243753
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|
14 0.0033807465 -0.0412482277
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15 0.0281067147 -0.3429709556
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16 0.1107330076 -0.0523783446
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|
17 -0.0566295182 0.0267878841
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|
18 0.0102748582 -0.0048587932
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19 -0.0374119660 0.0176955365
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20 -0.3110746760 0.1471428357
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|
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orbital 1 2 81 3.6902128335 1.0000000000
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1 0.0141734235 -0.0009741723
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2 -0.0530169114 0.0036527486
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3 -0.1584931678 0.0109203836
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4 -0.3564148272 0.0245580099
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5 0.0154696508 -0.0010632274
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6 0.0079316589 0.0117865385
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|
7 -0.0296733347 -0.0440858796
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|
8 0.0887065425 0.1318007575
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|
9 0.1994771789 0.2963866850
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10 -0.0086569154 -0.0128626428
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11 -0.0057097101 0.0003942414
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12 -0.0115511009 0.0007967338
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13 0.1710550801 -0.0117836964
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14 -0.3006209023 0.0207126284
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15 -0.0243220217 0.0016747010
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17 -0.0064663153 -0.0096041798
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|
18 -0.0957364223 -0.1422494797
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19 0.1682484308 0.2499878993
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|
20 0.0136109790 0.0202260662
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|
|
|
orbital 1 2 82 3.7541401403 1.0000000000
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1 0.0205070607 -0.1443064055
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2 0.0159999948 -0.1126103472
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3 -0.0017650835 0.0124431222
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|
4 -0.0008112188 0.0057080898
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5 0.0480910863 -0.3384338620
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6 -0.1352261709 0.0543937970
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7 -0.1055235228 0.0424474750
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8 -0.0116592281 0.0046918334
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|
9 -0.0053485747 0.0021514455
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10 0.3171381707 -0.1275683958
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11 -0.0134221858 0.0944625931
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12 0.0322805589 -0.2271685380
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13 0.0072913229 -0.0513024906
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14 -0.0053002917 0.0372935166
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15 -0.0457800902 0.3221779475
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16 0.0885128500 -0.0356066004
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|
17 -0.2128739401 0.0856281457
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|
18 0.0480734838 -0.0193369954
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|
19 -0.0349486151 0.0140581910
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20 -0.3019033241 0.1214414644
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|
|
|
orbital 1 2 83 3.8574265811 1.0000000000
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1 0.0736031238 0.0040438289
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2 -0.4042696741 -0.0222066234
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3 0.1187704279 0.0065251907
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4 0.1317545211 0.0072367786
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5 -0.1082179881 -0.0059442891
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|
6 -0.0332997976 -0.0657619439
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|
7 0.1828958829 0.3611913166
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8 0.0537345921 0.1061205400
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|
9 0.0596061892 0.1177157381
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|
10 -0.0489623522 -0.0966940943
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|
11 0.1169617933 0.0064239617
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|
12 0.2937661843 0.0161390824
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13 0.0854705804 0.0046943938
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|
14 -0.1004211078 -0.0055163386
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15 -0.0421647273 -0.0023185155
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|
16 -0.0529135412 -0.1044993395
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|
17 -0.1328983915 -0.2624569727
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|
18 0.0386703086 0.0763658448
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|
19 -0.0454290206 -0.0897193699
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20 -0.0190747725 -0.0376749880
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|
|
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orbital 1 2 84 3.8649579322 1.0000000000
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1 0.0727174061 -0.0157728714
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2 -0.3952255022 0.0857112126
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3 0.0387326893 -0.0083996049
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4 0.1351961440 -0.0293216152
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5 0.0334093974 -0.0072488121
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6 0.0500208710 0.0550928568
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7 -0.2718588497 -0.2994379259
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8 -0.0266461082 -0.0293492175
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9 -0.0929974455 -0.1024283369
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10 -0.0229769724 -0.0253052273
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11 0.0629687194 -0.0136557762
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12 0.3495965414 -0.0758169307
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13 0.0275081381 -0.0059677259
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|
14 -0.1152505320 0.0249939004
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15 0.0151867984 -0.0032939459
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16 0.0433172303 0.0477110770
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17 0.2404709412 0.2648612628
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|
18 -0.0189227638 -0.0208411201
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19 0.0792744724 0.0873174900
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20 -0.0104437623 -0.0115053773
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|
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orbital 1 2 85 4.4957282259 1.0112532927
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1 -0.0032496060 -0.0319198698
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2 0.0078996329 0.0777851880
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3 0.0413482229 0.4071336742
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4 0.0000208497 0.0002554230
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5 -0.0016789739 -0.0164969158
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6 -0.0260211482 0.0187647797
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7 0.0634077215 -0.0457290317
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8 -0.3319106481 0.2393873005
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9 -0.0002074939 0.0001568384
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10 0.0134543441 -0.0097064517
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11 -0.0045948727 -0.0452038057
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|
12 -0.0087094351 -0.0857481562
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13 0.0365899575 0.3603165792
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14 -0.0022807127 -0.0224376714
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15 -0.0015893022 -0.0156395774
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16 -0.0368449193 0.0265707930
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17 -0.0699091170 0.0504207731
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18 -0.2937383329 0.2118538764
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19 0.0182919756 -0.0131947465
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20 0.0127474032 -0.0091916807
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|
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orbital 1 2 86 4.6657314714 0.6874013288
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1 0.3552780082 -0.1930513026
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2 0.0232401308 -0.0126293811
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3 -0.0129849812 0.0070481663
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4 0.0308613514 -0.0167671639
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5 -0.1284123675 0.0697774057
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6 -0.3447806489 -0.2111388384
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7 -0.0225497876 -0.0138102684
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8 -0.0126210724 -0.0077216799
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9 0.0299557416 0.0183433992
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10 -0.1246200344 -0.0763144423
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|
11 -0.2920102424 0.1586624769
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12 0.0175014529 -0.0095097367
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13 0.0078893095 -0.0042934178
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14 0.0341177453 -0.0185388302
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15 0.0882448723 -0.0479476647
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16 0.2834513072 0.1735707585
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|
17 -0.0169900295 -0.0104036311
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|
18 0.0076428151 0.0046864102
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|
19 0.0331124680 0.0202777434
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20 0.0856583006 0.0524527287
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|
|
|
orbital 1 2 87 4.6671982157 0.0650853033
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1 -0.2173642441 -0.2841011441
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2 -0.0300426822 -0.0392666718
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3 -0.1125439686 -0.1471154062
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4 0.0200783779 0.0262464463
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|
5 0.0701588014 0.0916983468
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6 0.1373898730 -0.3303341189
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7 0.0189875780 -0.0456527064
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8 -0.0711312647 0.1710218881
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|
9 0.0126872133 -0.0305078431
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10 0.0443467946 -0.1066238241
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|
11 -0.1802153181 -0.2355713017
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12 0.0177803286 0.0232433826
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13 -0.0921557976 -0.1204625672
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|
14 -0.0107499449 -0.0140502556
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|
15 0.0572976134 0.0748964868
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16 0.1138713722 -0.2738227038
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17 -0.0112361132 0.0270188474
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|
18 -0.0582453687 0.1400408826
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19 -0.0067956427 0.0163372910
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20 0.0362052300 -0.0870591254
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|
|
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orbital 1 2 88 4.6927011264 0.0000000000
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1 -0.1714662299 -0.0796950690
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2 -0.0064141928 -0.0029807515
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3 0.3460828342 0.1608597742
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4 -0.0536700508 -0.0249481019
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5 0.0567566978 0.0263781250
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6 -0.0167226943 -0.1883413276
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7 -0.0006271465 -0.0070414529
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|
8 -0.0337392172 -0.3801532336
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|
9 0.0052306520 0.0589544646
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10 -0.0055335395 -0.0623458924
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11 -0.1460799519 -0.0678927077
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|
12 -0.0053692677 -0.0024956633
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13 0.2806367164 0.1304391868
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14 0.0266432903 0.0123835619
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15 0.0237546222 0.0110357512
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|
16 -0.0142397815 -0.1604505051
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17 -0.0005242322 -0.0058998132
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|
18 -0.0273554973 -0.3082552929
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19 -0.0025940088 -0.0292635732
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20 -0.0023144557 -0.0260882205
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|
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orbital 1 2 89 5.7535738799 0.0000000000
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1 -0.0584800231 0.0898480818
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2 -0.0539152034 0.0827892600
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3 0.1217664576 -0.1869256274
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4 -0.0694931705 0.1066762690
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5 0.0771467296 -0.1184822677
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6 -0.1070654998 -0.0057959332
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7 -0.0986677679 -0.0053184061
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8 -0.2227597146 -0.0119923078
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9 0.1271226071 0.0068280114
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10 -0.1411836917 -0.0076102420
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11 0.0760970134 -0.1167373231
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|
12 -0.0631994733 0.0969889765
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13 -0.1560189461 0.2395101834
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14 -0.0818588704 0.1256541294
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15 -0.0845797465 0.1298159155
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16 0.1391325181 0.0074442422
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|
17 -0.1155796398 -0.0062023950
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18 0.2854182174 0.0153544689
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19 0.1497527068 0.0080696529
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20 0.1547001093 0.0082941289
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|
|
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orbital 1 2 90 5.8535203976 0.0000000000
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1 -0.1435673801 -0.2167068334
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2 -0.0614075138 -0.0927133766
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3 0.0012969829 0.0020389024
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4 0.0227492423 0.0344004417
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5 0.0931133912 0.1406559341
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6 -0.1160306748 0.2325853928
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7 -0.0496476206 0.0995404966
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8 -0.0011032352 0.0021594953
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9 -0.0183853200 0.0369647989
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10 -0.0752994686 0.1509187556
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11 -0.1755383787 -0.2652857186
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|
12 0.0665209889 0.1005454217
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13 0.0015783035 0.0023921790
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14 -0.0205127365 -0.0310268373
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15 0.1103869030 0.1668516506
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|
16 -0.1418683863 0.2847078312
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17 0.0537565333 -0.1078855612
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18 -0.0012353329 0.0026004473
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20 -0.0892416718 0.1790942959
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orbital 1 2 91 5.9331827288 0.0000000000
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1 0.2392255477 0.0050571453
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2 0.0566234720 0.0011858775
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3 0.1447868399 0.0030957828
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4 -0.1078431288 -0.0023068075
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5 -0.1217647277 -0.0025653941
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6 0.1151685892 0.2097660506
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7 0.0272389780 0.0496568651
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8 -0.0697314923 -0.1269624128
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|
9 0.0519158517 0.0945624006
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10 0.0585969784 0.1067450906
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|
11 -0.2866767471 -0.0061768547
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12 0.0675435714 0.0014659944
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|
13 -0.1779352511 -0.0038132168
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14 -0.1196538999 -0.0025690261
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15 0.1422683174 0.0030693625
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|
16 -0.1380670102 -0.2512893289
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|
17 0.0325376664 0.0592038926
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|
18 0.0856919367 0.1560255237
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|
19 0.0576224023 0.1049170330
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|
20 -0.0685474857 -0.1247135705
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|
|
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orbital 1 2 92 6.3356312815 0.0000000000
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1 0.0511703151 0.0011690078
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2 -0.0689601050 -0.0016849954
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3 0.2493541968 0.0059943222
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|
4 -0.2035213427 -0.0049738628
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5 0.0426850408 0.0010535844
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6 -0.0245422854 -0.0449769435
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7 0.0329798806 0.0605626925
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8 0.1194094851 0.2189649372
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|
9 -0.0975787630 -0.1786273009
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10 0.0204773582 0.0375259042
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orbital 1 3 12 -59.4176097013 1.0000000000
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orbital 1 3 13 -20.9165267782 1.0000000000
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orbital 1 3 14 -20.8915822930 1.0000000000
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orbital 1 3 15 -20.8734987175 1.0000000000
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orbital 1 3 16 -20.8117725078 1.0000000000
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18 0.0000020791 0.0000033452
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20 0.0023154631 0.0032603082
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orbital 1 3 17 -20.8075903034 1.0000000000
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orbital 1 3 18 -20.8062912893 1.0000000000
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orbital 1 3 19 -20.7628443982 1.0000000000
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orbital 1 3 20 -20.7271586515 1.0000000000
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3 -0.0000684725 0.0001803763
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20 0.0002011478 0.0002466309
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orbital 1 3 21 -20.6576206619 1.0000000000
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1 0.0019231365 0.0000046140
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3 0.0018631834 0.0000045326
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3 -0.0004791622 -0.0016537042
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20 0.0025445648 0.0006267895
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orbital 1 3 25 -14.2678445697 1.0000000000
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11 -0.0007097609 0.0000390247
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12 -0.0049339235 0.0002708565
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13 -0.0081812161 0.0004491708
|
|
14 -0.0043391627 0.0002383351
|
|
15 0.0005006402 -0.0000274974
|
|
16 0.0003210457 -0.0006341155
|
|
17 0.0022323784 -0.0044083100
|
|
18 -0.0037015826 0.0073097027
|
|
19 -0.0019632744 0.0038770445
|
|
20 0.0002265089 -0.0004473697
|
|
|
|
orbital 1 3 26 -13.5854458516 1.0000000000
|
|
1 -0.0132076617 -0.0017001601
|
|
2 0.0032054455 0.0004125048
|
|
3 -0.0293222875 -0.0037740980
|
|
4 0.0160725915 0.0020687205
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|
5 0.0049245894 0.0006338903
|
|
6 -0.0080762349 0.0105881125
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7 0.0019599769 -0.0025697889
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8 0.0179294998 -0.0235069032
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|
9 -0.0098277637 0.0128849327
|
|
10 -0.0030113170 0.0039477801
|
|
11 -0.0109879328 -0.0014144229
|
|
12 -0.0041433779 -0.0005332275
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|
13 -0.0228225611 -0.0029375206
|
|
14 -0.0131389313 -0.0016911879
|
|
15 0.0042840432 0.0005514462
|
|
16 -0.0067188295 0.0088086314
|
|
17 -0.0025334736 0.0033216011
|
|
18 0.0139551501 -0.0182961831
|
|
19 0.0080339897 -0.0105331546
|
|
20 -0.0026195809 0.0034344045
|
|
|
|
orbital 1 3 27 -13.2579062324 1.0000000000
|
|
1 -0.0019163761 0.0015128498
|
|
2 -0.0011434682 0.0009026756
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3 -0.0064271880 0.0050755540
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|
4 0.0024848574 -0.0019621484
|
|
5 -0.0011956894 0.0009444762
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6 0.0003518347 0.0024160908
|
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7 0.0002098577 0.0014415750
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|
8 -0.0011823223 -0.0081037984
|
|
9 0.0004569941 0.0031329657
|
|
10 -0.0002200339 -0.0015077888
|
|
11 0.0165828724 -0.0130934599
|
|
12 0.0006532571 -0.0005159312
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|
13 0.0330151852 -0.0260690222
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|
14 0.0199484989 -0.0157514013
|
|
15 -0.0057182512 0.0045150565
|
|
16 -0.0030481155 -0.0209079406
|
|
17 -0.0001202237 -0.0008237102
|
|
18 0.0060689532 0.0416263053
|
|
19 0.0036668480 0.0251516877
|
|
20 -0.0010511919 -0.0072096729
|
|
|
|
orbital 1 3 28 -13.2382155736 1.0000000000
|
|
1 -0.0026129730 -0.0008265931
|
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2 0.0030808990 0.0009748006
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3 -0.0255700943 -0.0080896317
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|
4 0.0152689072 0.0048306194
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|
5 -0.0019913960 -0.0006300315
|
|
6 -0.0020223385 0.0018494679
|
|
7 0.0023846324 -0.0021807743
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8 0.0197907382 -0.0180997766
|
|
9 -0.0118178876 0.0108081150
|
|
10 0.0015411635 -0.0014095023
|
|
11 0.0035299357 0.0011171136
|
|
12 -0.0034655008 -0.0010966994
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|
13 -0.0083303463 -0.0026364963
|
|
14 -0.0066390463 -0.0021010551
|
|
15 -0.0026668184 -0.0008440856
|
|
16 0.0027322380 -0.0024986121
|
|
17 -0.0026825275 0.0024528763
|
|
18 0.0064486431 -0.0058957450
|
|
19 0.0051393279 -0.0046989735
|
|
20 0.0020643074 -0.0018875742
|
|
|
|
orbital 1 3 29 -13.1179699928 1.0000000000
|
|
1 0.0000103759 -0.0000271119
|
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2 0.0008344413 -0.0022024231
|
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3 -0.0048093340 0.0126912192
|
|
4 0.0025205580 -0.0066510259
|
|
5 -0.0006803465 0.0017949409
|
|
6 0.0000178220 0.0000228563
|
|
7 0.0014902303 0.0018241546
|
|
8 0.0085866235 0.0105105382
|
|
9 -0.0044998122 -0.0055080735
|
|
10 0.0012139717 0.0014866183
|
|
11 0.0077782200 -0.0205300594
|
|
12 -0.0028663021 0.0075651941
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|
13 0.0003371560 -0.0008906514
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14 0.0007007224 -0.0018497031
|
|
15 -0.0039840366 0.0105158375
|
|
16 0.0138908089 0.0170009785
|
|
17 -0.0051182955 -0.0062647527
|
|
18 -0.0006031346 -0.0007368214
|
|
19 -0.0012519700 -0.0015313765
|
|
20 0.0071151305 0.0087081921
|
|
|
|
orbital 1 3 30 -13.0476210313 1.0000000000
|
|
1 -0.0128140142 -0.0132864842
|
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2 -0.0040040245 -0.0041519354
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|
3 -0.0050756541 -0.0052623749
|
|
4 0.0035498253 0.0036805658
|
|
5 0.0050718212 0.0052587261
|
|
6 0.0179132185 -0.0044549913
|
|
7 0.0055974945 -0.0013921683
|
|
8 -0.0070952734 0.0017640183
|
|
9 0.0049623854 -0.0012340599
|
|
10 0.0070900235 -0.0017633721
|
|
11 0.0089625990 0.0092928547
|
|
12 -0.0001493633 -0.0001545622
|
|
13 0.0156756041 0.0162549709
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|
14 0.0093178716 0.0096621298
|
|
15 -0.0029767603 -0.0030861729
|
|
16 -0.0125289304 0.0031165157
|
|
17 0.0002082749 -0.0000525767
|
|
18 0.0219150479 -0.0054481620
|
|
19 0.0130268055 -0.0032385433
|
|
20 -0.0041609725 0.0010353461
|
|
|
|
orbital 1 3 31 -13.0032151127 1.0000000000
|
|
1 -0.0222727367 -0.0154536530
|
|
2 -0.0082381000 -0.0057157257
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|
3 0.0073983209 0.0051318470
|
|
4 -0.0011889058 -0.0008242421
|
|
5 0.0114274256 0.0079286149
|
|
6 -0.0245196513 0.0115619401
|
|
7 -0.0090689765 0.0042764843
|
|
8 -0.0081437862 0.0038404593
|
|
9 0.0013085455 -0.0006171802
|
|
10 -0.0125802054 0.0059321030
|
|
11 0.0227139466 0.0157601395
|
|
12 -0.0081497634 -0.0056545981
|
|
13 -0.0026755503 -0.0018557639
|
|
14 0.0007214986 0.0005009367
|
|
15 -0.0109014711 -0.0075640154
|
|
16 0.0250056934 -0.0117906719
|
|
17 -0.0089719973 0.0042304123
|
|
18 0.0029451587 -0.0013887192
|
|
19 -0.0007944365 0.0003746283
|
|
20 0.0120014733 -0.0056588303
|
|
|
|
orbital 1 3 32 -12.9200068291 1.0000000000
|
|
1 -0.0005381309 0.0003622963
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2 0.0049459054 -0.0033205960
|
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3 -0.0278948801 0.0187304125
|
|
4 0.0149229677 -0.0100203777
|
|
5 -0.0047421109 0.0031836634
|
|
6 0.0000449310 0.0006472070
|
|
7 -0.0004026067 -0.0059435762
|
|
8 -0.0022727831 -0.0335226603
|
|
9 0.0012159149 0.0179337553
|
|
10 -0.0003858185 -0.0056985807
|
|
11 0.0045762376 -0.0030704978
|
|
12 -0.0096406310 0.0064724705
|
|
13 -0.0410209186 0.0275435076
|
|
14 -0.0223675322 0.0150188703
|
|
15 -0.0083912828 0.0056332850
|
|
16 -0.0003712277 -0.0054982452
|
|
17 0.0007849145 0.0115852134
|
|
18 -0.0033420925 -0.0492966075
|
|
19 -0.0018225203 -0.0268801318
|
|
20 -0.0006829998 -0.0100836520
|
|
|
|
orbital 1 3 33 -12.8806638389 1.0000000000
|
|
1 0.0190531201 0.0173478300
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|
2 0.0106103266 0.0096615279
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|
3 -0.0251422375 -0.0228954449
|
|
4 0.0118530624 0.0107940557
|
|
5 -0.0119299910 -0.0108624254
|
|
6 -0.0245507708 0.0078251549
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|
7 -0.0136724649 0.0043575868
|
|
8 -0.0323995202 0.0103258409
|
|
9 0.0152745658 -0.0048679242
|
|
10 -0.0153725979 0.0048997206
|
|
11 0.0025040815 0.0022789738
|
|
12 -0.0067582052 -0.0061535958
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|
13 -0.0307702034 -0.0280200484
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|
14 -0.0172844247 -0.0157397428
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|
15 -0.0047621138 -0.0043361103
|
|
16 -0.0032263360 0.0010276611
|
|
17 0.0087087273 -0.0027752280
|
|
18 -0.0396515324 0.0126369622
|
|
19 -0.0222733452 0.0070985520
|
|
20 -0.0061365034 0.0019554295
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|
|
|
orbital 1 3 34 -12.8239514024 1.0000000000
|
|
1 0.0372016971 0.0122338161
|
|
2 0.0111739830 0.0036743310
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3 0.0073369032 0.0024137250
|
|
4 -0.0076652238 -0.0025211631
|
|
5 -0.0163500269 -0.0053767779
|
|
6 -0.0291960178 0.0261005009
|
|
7 -0.0087690752 0.0078394518
|
|
8 0.0057587558 -0.0051472930
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|
9 -0.0060158460 0.0053778041
|
|
10 -0.0128316214 0.0114712838
|
|
11 -0.0537008452 -0.0176588567
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|
12 0.0224808246 0.0073928956
|
|
13 0.0182019115 0.0059875629
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|
14 0.0056678748 0.0018649698
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|
15 0.0283504236 0.0093231365
|
|
16 0.0421434456 -0.0376762076
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|
17 -0.0176429129 0.0157722544
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|
18 0.0142862148 -0.0127698843
|
|
19 0.0044490392 -0.0039764089
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|
20 0.0222493850 -0.0198907966
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|
|
|
orbital 1 3 35 -12.8089191465 1.0000000000
|
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1 -0.0051745347 -0.0433938334
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2 -0.0016786706 -0.0140754256
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|
3 -0.0001221073 -0.0010397540
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|
4 0.0005478912 0.0046035562
|
|
5 0.0024071262 0.0201843262
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|
6 -0.0401674428 -0.0172147405
|
|
7 -0.0130288479 -0.0055845530
|
|
8 0.0009639319 0.0004091090
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|
9 -0.0042616691 -0.0018243517
|
|
10 -0.0186833701 -0.0080076743
|
|
11 -0.0066725057 -0.0559658187
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|
12 0.0023775827 0.0199379988
|
|
13 0.0005886947 0.0049207607
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|
14 -0.0002482538 -0.0020901951
|
|
15 0.0034301137 0.0287698556
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|
16 -0.0518057092 -0.0222018614
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|
17 0.0184556110 0.0079103664
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|
18 -0.0045533953 -0.0019567186
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|
19 0.0019356735 0.0008266151
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|
20 -0.0266308868 -0.0114136938
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|
|
|
orbital 1 3 36 -12.7933367775 1.0000000000
|
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1 -0.0063961736 0.0178188816
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2 0.0005747415 -0.0016037456
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|
3 -0.0140993385 0.0392922797
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|
4 0.0080800616 -0.0225169629
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5 0.0011412979 -0.0031776582
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|
6 -0.0122369914 -0.0144455851
|
|
7 0.0011004029 0.0013006620
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8 0.0269783563 0.0318566607
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|
9 -0.0154604804 -0.0182557319
|
|
10 -0.0021829281 -0.0025757312
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|
11 -0.0095956443 0.0267381156
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|
12 -0.0003655452 0.0010198361
|
|
13 -0.0173744547 0.0484199190
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|
14 -0.0104735450 0.0291877967
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|
15 0.0027705198 -0.0077191795
|
|
16 -0.0183624338 -0.0216753204
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|
17 -0.0006988816 -0.0008278728
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|
18 0.0332451149 0.0392572768
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|
19 0.0200406489 0.0236642526
|
|
20 -0.0053020034 -0.0062568820
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|
|
|
orbital 1 3 37 -2.2260373572 1.0000000000
|
|
1 -0.0178993781 0.0068912612
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2 0.0380102447 -0.0146340250
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|
3 -0.0486289538 0.0187221535
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|
4 0.0342832338 -0.0131990932
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|
5 -0.0177054643 0.0068164190
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6 0.0029817217 -0.0189469928
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|
7 -0.0063316782 0.0402348003
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|
8 -0.0081004521 0.0514749189
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|
9 0.0057107662 -0.0362897821
|
|
10 -0.0029495050 0.0187417074
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|
11 0.0268471878 -0.0103363277
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|
12 0.0401557440 -0.0154598623
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|
13 0.0507608795 -0.0195428414
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|
14 0.0450614829 -0.0173487039
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|
15 0.0284710567 -0.0109611055
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|
16 -0.0044721275 0.0284186808
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|
17 -0.0066890657 0.0425057247
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|
18 0.0084554735 -0.0537316792
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|
19 0.0075060231 -0.0476986588
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|
20 0.0047427965 -0.0301375081
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|
|
|
orbital 1 3 38 -1.8682914504 1.0000000000
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|
1 -0.0095444615 0.0154864308
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2 0.0225294013 -0.0365551825
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|
3 -0.0511445100 0.0829857840
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|
4 0.0420798954 -0.0682780284
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|
5 -0.0117212004 0.0190188615
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6 0.0086390651 0.0160086535
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|
7 -0.0203937447 -0.0377888882
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|
8 -0.0462960377 -0.0857853869
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|
9 0.0380910060 0.0705813374
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|
10 -0.0106102607 -0.0196600326
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|
11 0.0111546108 -0.0180984562
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|
12 0.0363456226 -0.0589737568
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|
13 0.0771582045 -0.1251950921
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|
14 0.0835139782 -0.1355073443
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|
15 0.0124059684 -0.0201302487
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|
16 -0.0100967803 -0.0187097762
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|
17 -0.0328999683 -0.0609629920
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|
18 0.0698437643 0.1294188049
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|
19 0.0755967138 0.1400791187
|
|
20 0.0112303095 0.0208092275
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|
|
|
orbital 1 3 39 -1.6545249855 1.0000000000
|
|
1 -0.0029541624 -0.0003292976
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|
2 -0.0449813685 -0.0050128812
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|
3 0.0952102045 0.0106110705
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|
4 -0.1214966845 -0.0135411479
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|
5 -0.0073952045 -0.0008245848
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|
6 -0.0017618122 0.0023944289
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|
7 -0.0268319205 0.0364487490
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|
8 -0.0567940767 0.0771496551
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|
9 0.0724745592 -0.0984495902
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|
10 0.0044116487 -0.0059925345
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|
11 -0.0180831366 -0.0020149308
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|
12 0.0314039011 0.0034995897
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|
13 0.0507643492 0.0056574044
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|
14 0.0977057684 0.0108895309
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|
15 -0.0358230898 -0.0039925837
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|
16 -0.0107867180 0.0146532352
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|
17 0.0187328502 -0.0254468046
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|
18 -0.0302817842 0.0411335849
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19 -0.0582832805 0.0791706974
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|
20 0.0213692979 -0.0290279257
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|
|
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orbital 1 3 40 -1.3522098175 1.0000000000
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1 0.0232873893 -0.0048322458
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2 0.0455311709 -0.0094477388
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|
3 -0.0337837441 0.0070106642
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|
4 -0.1015968760 0.0210802596
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5 -0.0315268762 0.0065417747
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6 -0.0074584774 0.0225835697
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|
7 -0.0145840635 0.0441548012
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8 -0.0108209891 0.0327630170
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|
9 -0.0325420097 0.0985256032
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|
10 -0.0100981398 0.0305739880
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|
11 0.0260421693 -0.0054041154
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|
12 -0.0560191263 0.0116236991
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|
13 -0.0253816442 0.0052676072
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14 0.1503434038 -0.0311942947
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|
15 -0.0460746554 0.0095604985
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|
16 -0.0083408498 0.0252551035
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|
17 0.0179434781 -0.0543258286
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|
18 -0.0081295166 0.0246147236
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19 0.0481554500 -0.1457988889
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|
20 -0.0147579766 0.0446816926
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|
|
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orbital 1 3 41 -1.0340537710 1.0000000000
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|
1 0.0094952272 -0.0040474258
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2 -0.0071157840 0.0030343206
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3 -0.0975288375 0.0415696428
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4 -0.0708489892 0.0301984502
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5 0.0036948493 -0.0015758320
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6 -0.0012437114 0.0102470876
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|
7 0.0009318316 -0.0076795000
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|
8 -0.0127620892 0.1052473818
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|
9 -0.0092708683 0.0764570939
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|
10 0.0004840386 -0.0039882356
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|
11 0.0109002342 -0.0046462723
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|
12 -0.0162907875 0.0069428041
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|
13 -0.2079888789 0.0886520338
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|
14 0.0300791139 -0.0128210043
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15 0.0146543960 -0.0062477802
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|
16 -0.0014282887 0.0117631135
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|
17 0.0021321767 -0.0175801558
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|
18 -0.0272185339 0.2244506120
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|
19 0.0039346640 -0.0324594901
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|
20 0.0019189334 -0.0158152218
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|
|
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orbital 1 3 42 -1.0107105868 1.0000000000
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|
1 0.0382977619 -0.0618933357
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2 0.0117528203 -0.0189879250
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3 0.0023886855 -0.0038622410
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|
4 -0.0139382642 0.0225236190
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5 0.0658175154 -0.1063685241
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|
6 -0.0344524196 -0.0641132493
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|
7 -0.0105678308 -0.0196722668
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|
8 0.0021518166 0.0039996371
|
|
9 -0.0125357151 -0.0233328493
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|
10 0.0592088221 0.1101838914
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|
11 0.0495172229 -0.0800246469
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|
12 -0.0192754265 0.0311429241
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|
13 -0.0076554344 0.0123709545
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14 0.0096929573 -0.0156599084
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15 0.0912983866 -0.1475494331
|
|
16 -0.0445450050 -0.0828952441
|
|
17 0.0173330697 0.0322642463
|
|
18 -0.0068822732 -0.0128149532
|
|
19 0.0087153084 0.0162246949
|
|
20 0.0821319067 0.1528415897
|
|
|
|
orbital 1 3 43 -0.9454173580 1.0000000000
|
|
1 0.0027388616 0.0054102081
|
|
2 -0.0459948088 -0.0909367348
|
|
3 0.0299581291 0.0592358056
|
|
4 0.0376671168 0.0744763210
|
|
5 -0.0048814339 -0.0096584040
|
|
6 0.0060548641 0.0003328867
|
|
7 -0.1017500527 -0.0056363642
|
|
8 -0.0662792035 -0.0036709190
|
|
9 -0.0833323319 -0.0046166306
|
|
10 0.0108050915 0.0006016721
|
|
11 -0.0017026353 -0.0033699824
|
|
12 0.0674933256 0.1334425228
|
|
13 0.0510635550 0.1009653288
|
|
14 -0.0474271699 -0.0937735712
|
|
15 -0.0045372783 -0.0089815225
|
|
16 -0.0037692051 -0.0002113214
|
|
17 0.1493116525 0.0082700708
|
|
18 -0.1129703068 -0.0062577812
|
|
19 0.1049237307 0.0058122785
|
|
20 0.0100468277 0.0005613088
|
|
|
|
orbital 1 3 44 -0.7454107919 1.0000000000
|
|
1 -0.0071400150 -0.0154781096
|
|
2 0.0145076235 0.0314512898
|
|
3 -0.1035095526 -0.2243666762
|
|
4 0.0677394240 0.1468398618
|
|
5 0.0026609013 0.0057694867
|
|
6 0.0169743852 0.0015535154
|
|
7 -0.0344918881 -0.0031589684
|
|
8 -0.2460618227 -0.0225429597
|
|
9 0.1610373446 0.0147513648
|
|
10 0.0063272546 0.0005780043
|
|
11 -0.0012336679 -0.0026622462
|
|
12 0.0348665738 0.0755664901
|
|
13 0.0970973983 0.2104838109
|
|
14 0.0897671913 0.1945851149
|
|
15 -0.0002591459 -0.0005707741
|
|
16 0.0029217082 0.0002689991
|
|
17 -0.0828748190 -0.0075946002
|
|
18 0.2308342370 0.0211431740
|
|
19 0.2133996648 0.0195481907
|
|
20 -0.0006244002 -0.0000556716
|
|
|
|
orbital 1 3 45 -0.7197584865 1.0000000000
|
|
1 0.0397257145 -0.0155080506
|
|
2 -0.0428412108 0.0167256809
|
|
3 -0.0408471083 0.0159527514
|
|
4 -0.0823846276 0.0321574180
|
|
5 -0.0541633627 0.0211440241
|
|
6 0.0064295989 -0.0421574945
|
|
7 -0.0069367078 0.0454640477
|
|
8 0.0066208727 -0.0433488106
|
|
9 0.0133353080 -0.0874267753
|
|
10 0.0087684045 -0.0574795028
|
|
11 -0.1354061746 0.0528643313
|
|
12 0.1178771510 -0.0460226052
|
|
13 -0.1855638653 0.0724349169
|
|
14 -0.0587231890 0.0229201304
|
|
15 0.0987225589 -0.0385437781
|
|
16 -0.0219243384 0.1436971795
|
|
17 0.0190877148 -0.1250952248
|
|
18 0.0300398379 -0.1969222344
|
|
19 0.0095015693 -0.0623174444
|
|
20 -0.0159837069 0.1047679092
|
|
|
|
orbital 1 3 46 -0.6678638298 1.0000000000
|
|
1 -0.1161186158 0.0870382723
|
|
2 -0.0862636380 0.0646607208
|
|
3 -0.0152726619 0.0114501241
|
|
4 -0.0203377404 0.0152446659
|
|
5 0.0752502293 -0.0564049605
|
|
6 -0.0173193658 -0.1440812094
|
|
7 -0.0128658112 -0.1070367240
|
|
8 0.0022797469 0.0189522344
|
|
9 0.0030318479 0.0252350783
|
|
10 -0.0112240708 -0.0933712086
|
|
11 -0.1738988888 0.1303496600
|
|
12 0.1205475960 -0.0903604405
|
|
13 -0.0444536688 0.0333224415
|
|
14 0.0083763044 -0.0062786272
|
|
15 0.1279671201 -0.0959214446
|
|
16 -0.0259353705 -0.2157772267
|
|
17 0.0179792637 0.1495775238
|
|
18 0.0066285222 0.0551596260
|
|
19 -0.0012513544 -0.0103928382
|
|
20 -0.0190850194 -0.1587836980
|
|
|
|
orbital 1 3 47 -0.5893990061 1.0000000000
|
|
1 -0.0908407949 -0.0374376959
|
|
2 -0.0935949926 -0.0385726999
|
|
3 -0.1288134369 -0.0530892473
|
|
4 0.0693733147 0.0285911525
|
|
5 0.0887539858 0.0365778763
|
|
6 -0.0778423632 0.0599516196
|
|
7 -0.0802029319 0.0617686188
|
|
8 0.1103837682 -0.0850118509
|
|
9 -0.0594475650 0.0457836747
|
|
10 -0.0760537329 0.0585755783
|
|
11 0.1036113170 0.0427004381
|
|
12 0.0444536299 0.0183215599
|
|
13 -0.0869238086 -0.0358242113
|
|
14 0.1014018745 0.0417922325
|
|
15 -0.0902399868 -0.0371901623
|
|
16 0.0887857341 -0.0683800963
|
|
17 0.0380933301 -0.0293381391
|
|
18 0.0744871335 -0.0573659604
|
|
19 -0.0868938659 0.0669208344
|
|
20 0.0773272543 -0.0595548939
|
|
|
|
orbital 1 3 48 -0.4053029220 1.0000000000
|
|
1 0.0131285343 -0.0087491091
|
|
2 -0.0198526609 0.0132366399
|
|
3 0.0316142164 -0.0210766503
|
|
4 0.0176210415 -0.0117461757
|
|
5 0.0913199464 -0.0608767292
|
|
6 0.0010153348 0.0157438054
|
|
7 -0.0015338308 -0.0238114411
|
|
8 -0.0024421689 -0.0379175107
|
|
9 -0.0013633081 -0.0211333893
|
|
10 -0.0070603915 -0.1095234873
|
|
11 -0.0448550569 0.0298974030
|
|
12 0.0037230195 -0.0024807838
|
|
13 -0.0581306034 0.0387535922
|
|
14 0.0154663405 -0.0103084939
|
|
15 -0.0979131817 0.0652721507
|
|
16 -0.0034693991 -0.0537947571
|
|
17 0.0002882527 0.0044638453
|
|
18 0.0044927273 0.0697202366
|
|
19 -0.0011975837 -0.0185471754
|
|
20 0.0075686390 0.1174306197
|
|
|
|
orbital 1 3 49 -0.3633469051 1.0000000000
|
|
1 0.0813948873 -0.0496883055
|
|
2 0.0830433645 -0.0506946087
|
|
3 -0.1052115470 0.0642271290
|
|
4 0.0549772964 -0.0335605981
|
|
5 -0.0416105802 0.0254029332
|
|
6 -0.0023342717 -0.0953342846
|
|
7 -0.0023813685 -0.0972651606
|
|
8 -0.0030158541 -0.1232294768
|
|
9 0.0015759168 0.0643927173
|
|
10 -0.0011918731 -0.0487366148
|
|
11 -0.2168697968 0.1323887737
|
|
12 0.0644145560 -0.0393225519
|
|
13 0.1129909196 -0.0689760966
|
|
14 0.0774807353 -0.0472970616
|
|
15 0.1099431444 -0.0671180842
|
|
16 0.0062197066 0.2540092286
|
|
17 -0.0018469388 -0.0754464191
|
|
18 0.0032397352 0.1323403683
|
|
19 0.0022213746 0.0907481908
|
|
20 0.0031519182 0.1287729589
|
|
|
|
orbital 1 3 50 -0.0988927586 1.0000000000
|
|
1 -0.0721978422 0.0307156480
|
|
2 -0.0934661926 0.0397643003
|
|
3 -0.0256071133 0.0108954192
|
|
4 -0.0097200220 0.0041360414
|
|
5 -0.0004006079 0.0001707823
|
|
6 0.0094962648 -0.0778846473
|
|
7 0.0122956735 -0.1008252339
|
|
8 -0.0033703132 0.0276241691
|
|
9 -0.0012789601 0.0104859202
|
|
10 -0.0000526830 0.0004312401
|
|
11 0.2620203220 -0.1114766960
|
|
12 0.0153519693 -0.0065309527
|
|
13 -0.0105903354 0.0045059200
|
|
14 0.0096144799 -0.0040909607
|
|
15 -0.0663112247 0.0282097264
|
|
16 -0.0344703660 0.2826542778
|
|
17 -0.0020205089 0.0165603138
|
|
18 -0.0013909317 0.0114248856
|
|
19 0.0012650548 -0.0103726952
|
|
20 -0.0087249246 0.0715324296
|
|
|
|
orbital 1 3 51 -0.0642406449 1.0000000000
|
|
1 0.0893591348 0.1755869427
|
|
2 -0.0105947372 -0.0208173241
|
|
3 -0.0487563620 -0.0957982000
|
|
4 0.0046400046 0.0091171687
|
|
5 -0.0359194678 -0.0705780015
|
|
6 0.1967434850 0.0104037022
|
|
7 -0.0233251392 -0.0012337329
|
|
8 0.1073424372 0.0056744640
|
|
9 -0.0102169045 -0.0005394605
|
|
10 0.0790806260 0.0041822984
|
|
11 0.0752067834 0.1477688541
|
|
12 0.0541705693 0.1064390055
|
|
13 0.0259806518 0.0510453045
|
|
14 0.0044979647 0.0088353500
|
|
15 -0.0098031980 -0.0192626156
|
|
16 0.1655763582 0.0087590942
|
|
17 0.1192645859 0.0063060851
|
|
18 -0.0571972800 -0.0030216214
|
|
19 -0.0099005494 -0.0005232510
|
|
20 0.0215839597 0.0011404891
|
|
|
|
orbital 1 3 52 0.0521085155 1.0000000000
|
|
1 -0.0313883330 0.1787294497
|
|
2 -0.0063916164 0.0259836719
|
|
3 -0.0264823185 0.1329118811
|
|
4 -0.0000902474 -0.0032640185
|
|
5 0.0103456891 -0.0527003396
|
|
6 0.1313460576 0.1239247610
|
|
7 0.0207834656 0.0171204259
|
|
8 -0.1005786283 -0.0906142754
|
|
9 0.0017870632 0.0025875895
|
|
10 0.0397351020 0.0360068071
|
|
11 0.0099554548 -0.0545479859
|
|
12 -0.0073674422 0.0675108969
|
|
13 0.0306087638 -0.1516090623
|
|
14 0.0038530649 -0.0251319509
|
|
15 -0.0093211691 0.0079894959
|
|
16 -0.0404343726 -0.0376353220
|
|
17 0.0454683596 0.0490082597
|
|
18 0.1150969640 0.1031662694
|
|
19 0.0179527400 0.0176985725
|
|
20 -0.0131810415 -0.0016620735
|
|
|
|
orbital 1 3 53 0.0521281571 1.0000000000
|
|
1 0.0188994475 -0.1558028349
|
|
2 -0.0056852839 0.0295585796
|
|
3 -0.0004370065 -0.0261219709
|
|
4 -0.0034009982 0.0217654432
|
|
5 -0.0005512725 0.0148336533
|
|
6 0.1185300876 0.1044163648
|
|
7 -0.0237874119 -0.0181980424
|
|
8 -0.0176372655 -0.0202793502
|
|
9 0.0170297343 0.0140020730
|
|
10 0.0105096672 0.0109037407
|
|
11 -0.0040176785 0.0367371633
|
|
12 0.0278358306 -0.1870031402
|
|
13 0.0023446458 0.0183705167
|
|
14 -0.0052354544 0.0378728530
|
|
15 -0.0356549071 0.2190598543
|
|
16 -0.0276808645 -0.0249524401
|
|
17 0.1454565269 0.1213697169
|
|
18 0.0111430998 0.0158275452
|
|
19 0.0292106947 0.0248892307
|
|
20 0.1722806622 0.1398288983
|
|
|
|
orbital 1 3 54 0.1284675187 1.0000000000
|
|
1 -0.0866066935 0.0124329427
|
|
2 0.0065989386 -0.0009486834
|
|
3 -0.0081638062 0.0011710349
|
|
4 0.0033547528 -0.0004811078
|
|
5 0.1631492336 -0.0234272224
|
|
6 0.0325351150 -0.0812205773
|
|
7 -0.0024786082 0.0061890105
|
|
8 -0.0030669565 0.0076549001
|
|
9 0.0012604376 -0.0031460025
|
|
10 0.0612861570 -0.1530043869
|
|
11 -0.1203143272 0.0172789567
|
|
12 -0.1115348612 0.0160116887
|
|
13 0.0214438393 -0.0030790597
|
|
14 -0.0024849460 0.0003569046
|
|
15 -0.0718634753 0.0103219248
|
|
16 0.0451932108 -0.1128327921
|
|
17 0.0418998271 -0.1045987127
|
|
18 0.0080552509 -0.0201101225
|
|
19 -0.0009319162 0.0023313574
|
|
20 -0.0269923561 0.0673961465
|
|
|
|
orbital 1 3 55 0.4162671089 1.0000000000
|
|
1 0.1919873234 -0.1383135250
|
|
2 0.0741414349 -0.0534141896
|
|
3 -0.0413777408 0.0298077655
|
|
4 -0.0121587136 0.0087589082
|
|
5 0.0366335529 -0.0263922547
|
|
6 0.0237893445 0.2354228863
|
|
7 0.0091868480 0.0909153965
|
|
8 0.0051273922 0.0507378453
|
|
9 0.0015069854 0.0149108675
|
|
10 -0.0045389914 -0.0449202951
|
|
11 0.0331006913 -0.0238484026
|
|
12 -0.0665579349 0.0479481322
|
|
13 -0.0423633032 0.0305199740
|
|
14 0.0373341266 -0.0268947223
|
|
15 0.0331165420 -0.0238589836
|
|
16 0.0041012247 0.0405922931
|
|
17 -0.0082456678 -0.0816153142
|
|
18 0.0052506811 0.0519481270
|
|
19 -0.0046257775 -0.0457798159
|
|
20 -0.0041030631 -0.0406085190
|
|
|
|
orbital 1 3 56 0.8155183506 1.0000000000
|
|
1 0.0505179863 0.1261974481
|
|
2 -0.0752161475 -0.1878975011
|
|
3 0.0069881826 0.0174580663
|
|
4 0.0158255812 0.0395338958
|
|
5 -0.0603142438 -0.1506705326
|
|
6 -0.1345485792 -0.0193484483
|
|
7 0.2003323800 0.0288090905
|
|
8 0.0186130136 0.0026769775
|
|
9 0.0421502427 0.0060611753
|
|
10 -0.1606415476 -0.0231009569
|
|
11 -0.0455955888 -0.1139004887
|
|
12 -0.0615516253 -0.1537612904
|
|
13 0.0207810803 0.0519140026
|
|
14 0.0160819129 0.0401732364
|
|
15 0.0199862002 0.0499286600
|
|
16 0.1214390040 0.0174628668
|
|
17 0.1639366098 0.0235749230
|
|
18 0.0553494693 0.0079591314
|
|
19 0.0428318063 0.0061592647
|
|
20 0.0532324396 0.0076551399
|
|
|
|
orbital 1 3 57 1.0513504340 1.0000000000
|
|
1 -0.0167800780 -0.0623224549
|
|
2 0.0246677304 0.0916167067
|
|
3 0.0318107987 0.1181571580
|
|
4 -0.0007019623 -0.0026074645
|
|
5 0.0513263286 0.1906321177
|
|
6 -0.0623642085 -0.0166296401
|
|
7 0.0916753379 0.0244424608
|
|
8 -0.1182334669 -0.0315287966
|
|
9 0.0026097694 0.0006954150
|
|
10 -0.1907547227 -0.0508647331
|
|
11 -0.0203763461 -0.0756815837
|
|
12 0.0414556048 0.1539716231
|
|
13 -0.0122808585 -0.0456055872
|
|
14 -0.0040158446 -0.0149126574
|
|
15 -0.0300134434 -0.1114725985
|
|
16 -0.0757327394 -0.0201954264
|
|
17 0.1540714299 0.0410831834
|
|
18 0.0456370000 0.0121678768
|
|
19 0.0149244710 0.0039798076
|
|
20 0.1115445589 0.0297428351
|
|
|
|
orbital 1 3 58 1.0816862092 1.0000000000
|
|
1 0.0183381375 0.1186142795
|
|
2 0.0222100472 0.1436475103
|
|
3 -0.0090419235 -0.0584843082
|
|
4 -0.0005512714 -0.0035673894
|
|
5 0.0007544934 0.0048694865
|
|
6 0.1118927958 0.0434263691
|
|
7 0.1355080442 0.0525884625
|
|
8 0.0551700536 0.0214129118
|
|
9 0.0033649701 0.0013053138
|
|
10 -0.0045943079 -0.0017805297
|
|
11 0.0066919113 0.0432832358
|
|
12 -0.0001874473 -0.0012209742
|
|
13 -0.0218110407 -0.1410693081
|
|
14 0.0035437601 0.0229184533
|
|
15 -0.0206771903 -0.1337342607
|
|
16 0.0408288539 0.0158465843
|
|
17 -0.0011511569 -0.0004486300
|
|
18 0.1330740316 0.0516453580
|
|
19 -0.0216203926 -0.0083915779
|
|
20 0.1261558085 0.0489592026
|
|
|
|
orbital 1 3 59 1.3561556711 1.0000000000
|
|
1 -0.0073644846 -0.0834492649
|
|
2 0.0152071060 0.1722988365
|
|
3 0.0113810537 0.1289840804
|
|
4 -0.0050296000 -0.0569905027
|
|
5 0.0024176340 0.0273920153
|
|
6 0.0759514628 0.0353470709
|
|
7 -0.1568187555 -0.0729805774
|
|
8 0.1173958975 0.0546344512
|
|
9 -0.0518683213 -0.0241391733
|
|
10 0.0249310446 0.0116039144
|
|
11 -0.0033663058 -0.0381397288
|
|
12 -0.0111905814 -0.1268033169
|
|
13 0.0111040452 0.1258157129
|
|
14 0.0004665833 0.0052730333
|
|
15 -0.0034133237 -0.0386662368
|
|
16 0.0347126912 0.0161555475
|
|
17 0.1154103636 0.0537089041
|
|
18 0.1145114543 0.0532932162
|
|
19 0.0047998622 0.0022338916
|
|
20 -0.0351915955 -0.0163772036
|
|
|
|
orbital 1 3 60 1.4481429787 1.0000000000
|
|
1 -0.0700013377 0.0632902157
|
|
2 0.0425434246 -0.0384649401
|
|
3 -0.0648071097 0.0585917934
|
|
4 0.0393770144 -0.0355977276
|
|
5 -0.1055755661 0.0954514805
|
|
6 -0.0198093563 -0.0922658042
|
|
7 0.0120381931 0.0560737854
|
|
8 0.0183358403 0.0854165248
|
|
9 -0.0111446661 -0.0519023199
|
|
10 0.0298759028 0.1391571221
|
|
11 -0.0504412719 0.0456025890
|
|
12 -0.0211897964 0.0191587560
|
|
13 -0.0472533443 0.0427186663
|
|
14 -0.0432512425 0.0391066482
|
|
15 -0.0964374358 0.0871900350
|
|
16 -0.0142755483 -0.0664874909
|
|
17 -0.0059982633 -0.0279315496
|
|
18 0.0133728373 0.0622860107
|
|
19 0.0122372905 0.0570050634
|
|
20 0.0272906986 0.1271147933
|
|
|
|
orbital 1 3 61 1.4653655190 1.0000000000
|
|
1 -0.0699157637 0.0686083410
|
|
2 0.0860178324 -0.0844102709
|
|
3 -0.1005600094 0.0986750744
|
|
4 -0.1234484857 0.1211382067
|
|
5 0.0214097127 -0.0210069626
|
|
6 0.0244577121 0.0948585443
|
|
7 -0.0300881755 -0.1166969073
|
|
8 -0.0351752791 -0.1364264884
|
|
9 -0.0431833101 -0.1674774286
|
|
10 0.0074897396 0.0290380094
|
|
11 0.0755467151 -0.0741302877
|
|
12 0.0794289034 -0.0779420668
|
|
13 0.1000048327 -0.0981290253
|
|
14 -0.1353444515 0.1328101870
|
|
15 0.0002928144 -0.0002827485
|
|
16 -0.0264266366 -0.1024862074
|
|
17 -0.0277852720 -0.1077561838
|
|
18 0.0349802241 0.1356673572
|
|
19 -0.0473465566 -0.1836215018
|
|
20 0.0001015259 0.0003915840
|
|
|
|
orbital 1 3 62 1.5578198782 1.0000000000
|
|
1 -0.1659477294 -0.0404963220
|
|
2 0.0424312296 0.0103548492
|
|
3 -0.0629524239 -0.0153633601
|
|
4 0.0596938618 0.0145680582
|
|
5 -0.1045132612 -0.0255052098
|
|
6 -0.1180454507 0.1234658712
|
|
7 0.0301819901 -0.0315700405
|
|
8 0.0447800587 -0.0468366418
|
|
9 -0.0424624131 0.0444123226
|
|
10 0.0743450010 -0.0777576657
|
|
11 0.0414435608 0.0101155130
|
|
12 0.0208694515 0.0050926297
|
|
13 -0.1319353256 -0.0321958776
|
|
14 0.0546606267 0.0133405304
|
|
15 0.0869666728 0.0212231013
|
|
16 0.0294812685 -0.0308353278
|
|
17 0.0148450520 -0.0155266531
|
|
18 0.0938519233 -0.0981601295
|
|
19 -0.0388819204 0.0406691486
|
|
20 -0.0618632855 0.0647040315
|
|
|
|
orbital 1 3 63 1.6582658680 1.0000000000
|
|
1 0.0097349332 0.0780486845
|
|
2 0.0025018360 0.0200491554
|
|
3 -0.0105264330 -0.0843899867
|
|
4 -0.0110778318 -0.0888023932
|
|
5 0.0065725877 0.0526924983
|
|
6 0.0724605718 0.0305939047
|
|
7 0.0186140185 0.0078592016
|
|
8 0.0783477512 0.0330790641
|
|
9 0.0824429548 0.0348075882
|
|
10 -0.0489196781 -0.0206542540
|
|
11 -0.0122758864 -0.0984128816
|
|
12 -0.0155840537 -0.1249261265
|
|
13 0.0081046937 0.0649707716
|
|
14 -0.0111163105 -0.0891179992
|
|
15 -0.0146949512 -0.1177989407
|
|
16 -0.0913659173 -0.0385740650
|
|
17 -0.1159814722 -0.0489674355
|
|
18 -0.0603198528 -0.0254670546
|
|
19 0.0827356919 0.0349308624
|
|
20 0.1093645472 0.0461740853
|
|
|
|
orbital 1 3 64 1.7334210292 1.0000000000
|
|
1 0.0006184193 -0.0002180603
|
|
2 -0.1238189076 0.0441681850
|
|
3 -0.1953499286 0.0696813789
|
|
4 -0.0405384068 0.0144600175
|
|
5 0.0600437596 -0.0214170716
|
|
6 0.0001180104 -0.0006439521
|
|
7 -0.0236617930 0.1293133298
|
|
8 0.0373275408 -0.2040180755
|
|
9 0.0077459668 -0.0423386067
|
|
10 -0.0114733590 0.0627079958
|
|
11 -0.1131679068 0.0403671655
|
|
12 0.0110088543 -0.0039270991
|
|
13 -0.0304387874 0.0108588941
|
|
14 -0.0744627596 0.0265628008
|
|
15 -0.0654582411 0.0233473335
|
|
16 -0.0216265061 0.1181890044
|
|
17 0.0021033604 -0.0114976736
|
|
18 0.0058182998 -0.0317908470
|
|
19 0.0142309038 -0.0777679563
|
|
20 0.0125085927 -0.0683618272
|
|
|
|
orbital 1 3 65 1.8599725239 1.0000000000
|
|
1 0.0014522634 0.0021578764
|
|
2 0.0127037848 0.0188834712
|
|
3 -0.0010531138 -0.0015689888
|
|
4 -0.0202451365 -0.0300913894
|
|
5 -0.0490093213 -0.0728498412
|
|
6 -0.0025944837 0.0001792276
|
|
7 -0.0227045037 0.0015593880
|
|
8 -0.0018860309 0.0001310381
|
|
9 -0.0361848508 0.0024880060
|
|
10 -0.0875942414 0.0060165589
|
|
11 -0.0113679485 -0.0169003842
|
|
12 -0.0129361521 -0.0192320767
|
|
13 -0.0045345302 -0.0067445387
|
|
14 0.0236475600 0.0351606207
|
|
15 -0.0416091808 -0.0618571639
|
|
16 0.0203204489 -0.0013990519
|
|
17 0.0231233884 -0.0015851514
|
|
18 -0.0081102179 0.0005560218
|
|
19 0.0422741483 -0.0029025270
|
|
20 -0.0743745373 0.0051085505
|
|
|
|
orbital 1 3 66 1.8834369117 1.0000000000
|
|
1 0.0440680713 0.0519106055
|
|
2 0.0844081167 0.0994296228
|
|
3 -0.0634478742 -0.0747385429
|
|
4 -0.0980836696 -0.1155436600
|
|
5 -0.0398462507 -0.0469370189
|
|
6 -0.0669910598 0.0122096648
|
|
7 -0.1283125320 0.0233827477
|
|
8 -0.0964478093 0.0175765976
|
|
9 -0.1491031278 0.0271735740
|
|
10 -0.0605726362 0.0110404188
|
|
11 -0.0334659450 -0.0394201739
|
|
12 0.0701513378 0.0826364927
|
|
13 0.0784737657 0.0924386172
|
|
14 -0.1010200315 -0.1189997854
|
|
15 0.0417934629 0.0492311243
|
|
16 0.0508694767 -0.0092727140
|
|
17 -0.1066400906 0.0194333242
|
|
18 0.1192932603 -0.0217381817
|
|
19 -0.1535673610 0.0279869157
|
|
20 0.0635339873 -0.0115766077
|
|
|
|
orbital 1 3 67 2.1590912644 1.0000000000
|
|
1 0.0347439209 0.0036076399
|
|
2 0.0505079953 0.0052391102
|
|
3 0.0585090596 0.0060703273
|
|
4 0.0235990528 0.0024528575
|
|
5 -0.0195556952 -0.0020284564
|
|
6 0.0204920954 -0.0282877497
|
|
7 0.0297829604 -0.0411247086
|
|
8 -0.0345099946 0.0476321578
|
|
9 -0.0139160046 0.0192162532
|
|
10 0.0115347190 -0.0159201316
|
|
11 0.0345663757 0.0035862252
|
|
12 0.0407117206 0.0042211264
|
|
13 0.0709385021 0.0073556619
|
|
14 -0.0210398463 -0.0021787193
|
|
15 -0.0316163017 -0.0032793754
|
|
16 0.0203888081 -0.0281419818
|
|
17 0.0240088934 -0.0331483207
|
|
18 -0.0418401979 0.0577557077
|
|
19 0.0124180731 -0.0171283951
|
|
20 0.0186476482 -0.0257427781
|
|
|
|
orbital 1 3 68 2.1932424925 1.0000000000
|
|
1 0.0015406555 0.0448548749
|
|
2 -0.0022923737 -0.0668460743
|
|
3 0.0028697369 0.0835173224
|
|
4 -0.0053849622 -0.1568107365
|
|
5 0.0022393658 0.0652248425
|
|
6 -0.0396151525 -0.0210945848
|
|
7 0.0590386364 0.0314321000
|
|
8 0.0737643199 0.0392738401
|
|
9 -0.1384969159 -0.0737423652
|
|
10 0.0576075301 0.0306730960
|
|
11 0.0024167451 0.0703429584
|
|
12 0.0011857548 0.0344304732
|
|
13 0.0054381443 0.1583030876
|
|
14 0.0008047849 0.0233597240
|
|
15 0.0005309720 0.0154968142
|
|
16 -0.0621253393 -0.0330795327
|
|
17 -0.0304089287 -0.0161943418
|
|
18 0.1398108171 0.0744456570
|
|
19 0.0206311154 0.0109836540
|
|
20 0.0136851321 0.0072849800
|
|
|
|
orbital 1 3 69 2.2087432620 1.0000000000
|
|
1 0.0160881431 0.0285060497
|
|
2 -0.0579418725 -0.1026910246
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|
3 0.0312738100 0.0553917363
|
|
4 0.0154710053 0.0273877464
|
|
5 0.0018963619 0.0033686043
|
|
6 0.0327319677 0.0003210097
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|
7 -0.1179053554 -0.0011547430
|
|
8 -0.0636032238 -0.0006431653
|
|
9 -0.0314522482 -0.0003239809
|
|
10 -0.0038680668 -0.0000305823
|
|
11 0.0002243322 0.0004021352
|
|
12 -0.0460139041 -0.0815521890
|
|
13 0.0003173499 0.0005879608
|
|
14 -0.0021830714 -0.0039023006
|
|
15 0.0210413214 0.0372812028
|
|
16 0.0004602379 0.0000067164
|
|
17 -0.0936324743 -0.0009153285
|
|
18 -0.0006701336 0.0000086700
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|
19 0.0044761750 0.0000280877
|
|
20 -0.0428065316 -0.0004270192
|
|
|
|
orbital 1 3 70 2.2135905536 1.0000000000
|
|
1 -0.0040022457 -0.0152609027
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|
2 -0.0224971265 -0.0858801078
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|
3 -0.0696895061 -0.2659269343
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|
4 -0.0467728443 -0.1784885520
|
|
5 0.0192194437 0.0733504098
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|
6 0.0152167714 0.0041690018
|
|
7 0.0856249433 0.0234415176
|
|
8 -0.2651427427 -0.0726149966
|
|
9 -0.1779618899 -0.0487402674
|
|
10 0.0731326362 0.0200292340
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|
11 -0.0008272599 -0.0031618706
|
|
12 -0.0247077943 -0.0943123673
|
|
13 0.0424270563 0.1619075683
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|
14 -0.0697127641 -0.2660288039
|
|
15 -0.0184406286 -0.0703620003
|
|
16 0.0031510498 0.0008622264
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|
17 0.0940332813 0.0257455726
|
|
18 0.1614293330 0.0442113427
|
|
19 -0.2652440938 -0.0726421354
|
|
20 -0.0701540178 -0.0192159101
|
|
|
|
orbital 1 3 71 2.5236068882 1.0000000000
|
|
1 0.0080904636 -0.0184648225
|
|
2 0.0287409803 -0.0656080511
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|
3 -0.0037963356 0.0086597087
|
|
4 -0.0347081444 0.0792373070
|
|
5 -0.0794810901 0.1814456096
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|
6 -0.0119511112 -0.0162380187
|
|
7 -0.0424499323 -0.0576956066
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|
8 -0.0056060053 -0.0076172856
|
|
9 -0.0512673500 -0.0696789097
|
|
10 -0.1173923020 -0.1595576616
|
|
11 -0.0004758470 0.0010873355
|
|
12 -0.0241108958 0.0550433358
|
|
13 -0.0039856815 0.0091037442
|
|
14 0.0311180209 -0.0710341817
|
|
15 -0.0816041774 0.1862903121
|
|
16 0.0007006441 0.0009547682
|
|
17 0.0356140209 0.0484044543
|
|
18 -0.0058870300 -0.0080039111
|
|
19 0.0459601152 0.0624682382
|
|
20 -0.1205272894 -0.1638175393
|
|
|
|
orbital 1 3 72 2.5842518479 1.0000000000
|
|
1 -0.0506116779 -0.0527384911
|
|
2 0.0019444519 0.0020286635
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|
3 -0.0050553630 -0.0052721548
|
|
4 0.0030067926 0.0031337658
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|
5 -0.0887688780 -0.0925000928
|
|
6 0.0709781191 -0.0174603665
|
|
7 -0.0027287436 0.0006686290
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|
8 -0.0070953392 0.0017452810
|
|
9 0.0042139682 -0.0010375001
|
|
10 -0.1244956871 0.0306173743
|
|
11 -0.0455583658 -0.0474774994
|
|
12 -0.0062579653 -0.0065179666
|
|
13 0.0014229853 0.0014881989
|
|
14 -0.0031733104 -0.0033015841
|
|
15 -0.0904055827 -0.0942128925
|
|
16 0.0638979114 -0.0157210219
|
|
17 0.0087747810 -0.0021545603
|
|
18 0.0020005339 -0.0004920921
|
|
19 -0.0044444101 0.0010933233
|
|
20 -0.1267960423 0.0311861199
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|
|
|
orbital 1 3 73 3.0775540896 1.0000000000
|
|
1 0.1540557628 0.0556666111
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|
2 0.0835676372 0.0301964668
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|
3 -0.0061854411 -0.0022363244
|
|
4 0.2963223060 0.1070725393
|
|
5 0.2141538764 0.0773824833
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|
6 -0.1252358896 0.1055817866
|
|
7 -0.0679344571 0.0572734789
|
|
8 -0.0050284422 0.0042401808
|
|
9 0.2408884133 -0.2030846209
|
|
10 0.1740913488 -0.1467720705
|
|
11 0.1547072537 0.0559011048
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|
12 -0.0660940314 -0.0238818290
|
|
13 -0.0006583333 -0.0002377091
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|
14 -0.2687190037 -0.0970975162
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|
15 0.2469394922 0.0892281636
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|
16 -0.1257662546 0.1060276173
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|
17 0.0537299630 -0.0452966366
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|
18 -0.0005356282 0.0004517125
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|
19 -0.2184508176 0.1841678497
|
|
20 0.2007443701 -0.1692406271
|
|
|
|
orbital 1 3 74 3.1583694489 1.0000000000
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|
1 0.0387650231 0.0996723471
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|
2 -0.0843543808 -0.2168876612
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|
3 -0.0173150545 -0.0445261990
|
|
4 0.0860422203 0.2212325176
|
|
5 -0.0039177590 -0.0100720962
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|
6 0.1056989594 0.0162635297
|
|
7 -0.2300090325 -0.0353923778
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|
8 0.0472169384 0.0072662686
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|
9 -0.2346133948 -0.0361016997
|
|
10 0.0106832543 0.0016441534
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|
11 -0.0374343437 -0.0962518026
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|
12 -0.1490510465 -0.3832389743
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|
13 0.0283537399 0.0729066840
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|
14 -0.0584828193 -0.1503777275
|
|
15 0.0046353293 0.0119201290
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|
16 -0.1020737866 -0.0157080317
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|
17 -0.4064217523 -0.0625385728
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|
18 -0.0773150787 -0.0118979945
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|
19 0.1594739264 0.0245412637
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|
20 -0.0126413560 -0.0019456013
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|
|
|
orbital 1 3 75 3.2021712316 1.0000000000
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|
1 -0.0583019120 -0.0051381771
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|
2 0.3099006187 0.0273100962
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3 0.0276255202 0.0024352079
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|
4 0.3461117741 0.0305045486
|
|
5 -0.0008107609 -0.0000712674
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|
6 -0.0335996966 0.0479230715
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|
7 0.1786023857 -0.2547265992
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|
8 -0.0159209617 0.0227081959
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|
9 -0.1994736938 0.2844892810
|
|
10 0.0004663895 -0.0006676502
|
|
11 0.0495801653 0.0043682043
|
|
12 0.0585663433 0.0051598072
|
|
13 0.0039368926 0.0003461923
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|
14 -0.3949650744 -0.0348070063
|
|
15 -0.0116824654 -0.0010301742
|
|
16 0.0285731955 -0.0407536408
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|
17 0.0337515882 -0.0481398617
|
|
18 -0.0022698146 0.0032358575
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|
19 0.2276267422 -0.3246449482
|
|
20 0.0067333600 -0.0096026160
|
|
|
|
orbital 1 3 76 3.2694246565 1.0000000000
|
|
1 0.1682629767 0.0652570561
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|
2 0.0433344701 0.0168068790
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3 -0.0423053191 -0.0164062026
|
|
4 0.0805759604 0.0312510091
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|
5 0.3012356275 0.1168293957
|
|
6 0.1406466715 -0.1130889251
|
|
7 0.0362238766 -0.0291230502
|
|
8 0.0353606395 -0.0284311192
|
|
9 -0.0673529492 0.0541560298
|
|
10 -0.2517946372 0.2024617115
|
|
11 -0.1837378813 -0.0712593771
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|
12 0.0521861396 0.0202409941
|
|
13 0.0353749966 0.0137177826
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|
14 0.0795991382 0.0308705179
|
|
15 -0.3259244620 -0.1264047227
|
|
16 -0.1535818061 0.1234921638
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|
17 0.0436230408 -0.0350739219
|
|
18 -0.0295676341 0.0237730846
|
|
19 -0.0665337734 0.0534972500
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|
20 0.2724333442 -0.2190557720
|
|
|
|
orbital 1 3 77 3.3695762031 1.0000000000
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|
1 0.0190262065 -0.0364949749
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|
2 -0.1291803723 0.2477832707
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|
3 -0.0684224273 0.1312463610
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|
4 -0.0176441716 0.0338515786
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5 0.0328845522 -0.0630784745
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6 0.0220924011 0.0347249646
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|
7 -0.1499968906 -0.2357667328
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8 0.0794509733 0.1248797162
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|
9 0.0204937077 0.0322079777
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|
10 -0.0381856653 -0.0600181682
|
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11 -0.0369326770 0.0708419835
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|
12 -0.1453877824 0.2788693414
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13 0.0657517642 -0.1261232047
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14 -0.0497534422 0.0954388091
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|
15 -0.0523192434 0.1003563117
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16 -0.0428849394 -0.0674083576
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17 -0.1688133921 -0.2653435924
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|
18 -0.0763492736 -0.1200051623
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|
19 0.0577741732 0.0908092132
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20 0.0607505834 0.0954901065
|
|
|
|
orbital 1 3 78 3.4839827030 1.0000000000
|
|
1 0.1071795688 -0.0576982874
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2 -0.0885126640 0.0476506727
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3 -0.0003454612 0.0001859768
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|
4 -0.3265207821 0.1757755740
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5 0.1557984034 -0.0838725754
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6 -0.0036225495 0.1216702001
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7 0.0029887280 -0.1004811013
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|
8 -0.0000117647 0.0003919180
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|
9 -0.0110362830 0.3706640868
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10 0.0052625400 -0.1768628375
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11 0.1039303737 -0.0559490187
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|
12 0.0607250553 -0.0326868591
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|
13 0.0581722026 -0.0313153398
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14 0.1882258615 -0.1013273518
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15 0.2118803184 -0.1140590807
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|
16 -0.0035132581 0.1179799200
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|
17 -0.0020535048 0.0689339758
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|
18 0.0019669912 -0.0660376150
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|
19 0.0063598032 -0.2136707934
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|
20 0.0071616383 -0.2405217811
|
|
|
|
orbital 1 3 79 3.5267553654 1.0000000000
|
|
1 -0.0205339041 -0.0525196857
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2 0.0609456188 0.1558704097
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3 -0.0298171420 -0.0762409160
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|
4 -0.0632947651 -0.1618756061
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|
5 -0.0891024642 -0.2279036730
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6 0.0557534250 0.0084799021
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7 -0.1654565685 -0.0251530051
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8 -0.0809363685 -0.0123055779
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|
9 -0.1718333035 -0.0261297026
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10 -0.2419218412 -0.0367809995
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11 0.0069199313 0.0177068377
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12 0.0666434398 0.1704458296
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|
13 0.0327265377 0.0836946243
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|
14 -0.1032530350 -0.2640742324
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|
15 0.0385841640 0.0986958327
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|
16 -0.0187860481 -0.0028505781
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|
17 -0.1809292297 -0.0275131646
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|
18 0.0888390344 0.0135004413
|
|
19 -0.2803222770 -0.0426197024
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20 0.1047677696 0.0159271834
|
|
|
|
orbital 1 3 80 3.6350781424 1.0000000000
|
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1 -0.0046665902 -0.1505179872
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2 -0.0024951631 -0.0804459304
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3 0.0006060737 0.0195725853
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4 0.0015618111 0.0503479278
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|
5 -0.0127704587 -0.4118656798
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6 -0.1326865773 -0.0712152081
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7 -0.0709173273 -0.0380609850
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8 -0.0172542831 -0.0092600247
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9 -0.0443839468 -0.0238221311
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10 0.3630720950 0.1948704717
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11 -0.0037961984 -0.1224356775
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|
12 0.0019423361 0.0626149977
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13 0.0003538849 0.0113586623
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|
14 -0.0012820195 -0.0413675040
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|
15 -0.0106666980 -0.3439549902
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|
16 -0.1079318035 -0.0579299989
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|
17 0.0551985248 0.0296247719
|
|
18 -0.0100123005 -0.0053739900
|
|
19 0.0364670187 0.0195714768
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|
20 0.3032068724 0.1627414140
|
|
|
|
orbital 1 3 81 3.6902128711 1.0000000000
|
|
1 0.0141222550 0.0015425524
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2 -0.0528286964 -0.0057709894
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3 -0.1579323783 -0.0172466458
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|
4 -0.3551498069 -0.0387869495
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5 0.0154167445 0.0016840637
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6 0.0083975440 -0.0114612204
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7 -0.0314124040 0.0428627868
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8 0.0939058972 -0.1281491111
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|
9 0.2111664080 -0.2881710118
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10 -0.0091634906 0.0125081522
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11 -0.0056942313 -0.0006211950
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12 -0.0115082192 -0.0012590180
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13 0.1704481717 0.0186167920
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14 -0.2995530951 -0.0327158352
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|
15 -0.0242380240 -0.0026469409
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16 -0.0033835130 0.0046210194
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17 -0.0068435731 0.0093378664
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|
18 -0.1013462169 0.1383045428
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|
19 0.1781101375 -0.2430605869
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|
20 0.0144079449 -0.0196636236
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|
|
|
orbital 1 3 82 3.7541402891 1.0000000000
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1 -0.0080062251 -0.1455360406
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2 -0.0062476224 -0.1135704323
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3 0.0006901608 0.0125482324
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|
4 0.0003178547 0.0057541855
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|
5 -0.0187762746 -0.3413177960
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6 0.1300404053 0.0658335016
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|
7 0.1014757354 0.0513729284
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8 0.0112155575 0.0056771606
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|
9 0.0051453890 0.0026046726
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|
10 -0.3049793544 -0.1543982839
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|
11 0.0052401137 0.0952624565
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|
12 -0.0126031598 -0.2291040994
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|
13 -0.0028468470 -0.0517381942
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14 0.0020699687 0.0376116336
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|
15 0.0178748177 0.3249213713
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|
16 -0.0851253127 -0.0430947510
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|
17 0.2047113025 0.1036388044
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|
18 -0.0462300130 -0.0234028145
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|
19 0.0336107720 0.0170165034
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|
20 0.2903272905 0.1469830205
|
|
|
|
orbital 1 3 83 3.8574264909 1.0000000000
|
|
1 0.0092895228 -0.0731308019
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2 -0.0510226102 0.4016581714
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3 0.0149901040 -0.1180045786
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|
4 0.0166287360 -0.1309043590
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|
5 -0.0136572873 0.1075159171
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6 0.0586832350 0.0446055367
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7 -0.3223059109 -0.2449888883
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8 -0.0946977319 -0.0719809561
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|
9 -0.1050428442 -0.0798443471
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|
10 0.0862864293 0.0655871800
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11 0.0147618968 -0.1162039042
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|
12 0.0370771389 -0.2918703127
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|
13 0.0107881241 -0.0849186091
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|
14 -0.0126740078 0.0997706593
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|
15 -0.0053219695 0.0418916758
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|
16 0.0932526958 0.0708822832
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|
17 0.2342020863 0.1780194265
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|
18 -0.0681457301 -0.0517995020
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|
19 0.0800584447 0.0608542156
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20 0.0336194592 0.0255537911
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|
|
|
orbital 1 3 84 3.8649579464 1.0000000000
|
|
1 0.0000305063 0.0744077165
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2 -0.0001705777 -0.4044069553
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3 0.0000192257 0.0396300921
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|
4 0.0000580627 0.1383364935
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|
5 0.0000128079 0.0341878173
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6 0.0644601751 0.0371779864
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7 -0.3503482236 -0.2020697136
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8 -0.0343410039 -0.0198064589
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9 -0.1198468656 -0.0691237964
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|
10 -0.0296044018 -0.0170778359
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11 0.0000284576 0.0644321255
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12 0.0001511075 0.3577174216
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13 0.0000117184 0.0281420192
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14 -0.0000520613 -0.1179294267
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|
15 0.0000059081 0.0155416322
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|
16 0.0558272737 0.0321963637
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17 0.3098918118 0.1787386362
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|
18 -0.0243886560 -0.0140667750
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19 0.1021611468 0.0589253650
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20 -0.0134603463 -0.0077654471
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|
|
|
orbital 1 3 85 4.4957280617 1.0112533670
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1 -0.0267792013 -0.0176670077
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2 0.0652618146 0.0430533359
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3 0.3415995215 0.2253297911
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|
4 0.0002195090 0.0001424235
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|
5 -0.0138448617 -0.0091248890
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6 0.0286774127 -0.0143597209
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|
7 -0.0699169612 0.0349967661
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8 0.3659406234 -0.1831738482
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|
9 0.0002291234 -0.0001109049
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|
10 -0.0148325137 0.0074239771
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|
11 -0.0379295608 -0.0250233285
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|
12 -0.0719477337 -0.0474574221
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|
13 0.3023188999 0.1994281314
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|
14 -0.0188275000 -0.0124121647
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|
15 -0.0131183019 -0.0086531129
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|
16 0.0406224247 -0.0203460816
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17 0.0770770171 -0.0385761747
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|
18 0.3238689015 -0.1621105771
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|
19 -0.0201641840 0.0100933273
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20 -0.0140574465 0.0070394789
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|
|
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orbital 1 3 86 4.6657314052 0.6874020894
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1 -0.3957536778 0.0836873788
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2 -0.0259039822 0.0054600596
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3 0.0143339506 -0.0031613399
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4 -0.0343336745 0.0073071348
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|
5 0.1430335867 -0.0302558264
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6 0.1247762648 -0.3843853349
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7 0.0081394755 -0.0251367533
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8 0.0047254927 -0.0141312147
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|
9 -0.0108926256 0.0334145785
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10 0.0451119745 -0.1389359561
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11 0.3249168816 -0.0691594612
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|
12 -0.0194656189 0.0041515603
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13 -0.0088853812 0.0017867897
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14 -0.0379951471 0.0080507748
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15 -0.0981852116 0.0209016718
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|
16 -0.1030851860 0.3161247928
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17 0.0061899824 -0.0189530195
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|
18 -0.0026526544 0.0084760678
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19 -0.0119983964 0.0369195267
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20 -0.0311546129 0.0955362057
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orbital 1 3 87 4.6671982366 0.0650853582
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1 -0.2493064321 -0.2562570243
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2 -0.0344799949 -0.0354179119
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3 -0.1292720619 -0.1326815669
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4 0.0230882718 0.0236661780
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5 0.0804538227 0.0827119064
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6 -0.3468553393 0.0884534457
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7 -0.0479279154 0.0121995838
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8 0.1795241394 -0.0455815477
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|
9 -0.0320174395 0.0081025663
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10 -0.1119599096 0.0285638478
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11 -0.2072799927 -0.2123622291
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12 0.0204410882 0.0209564905
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13 -0.1058341745 -0.1086501467
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|
14 -0.0123113918 -0.0126810416
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15 0.0658971859 0.0675216245
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16 -0.2873206261 0.0727751991
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17 0.0283533346 -0.0071900455
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|
18 0.1470052969 -0.0373414424
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19 0.0171617072 -0.0043884328
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|
20 -0.0913559381 0.0231356097
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|
|
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orbital 1 3 88 4.6927017649 0.0000000000
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1 -0.1556182351 0.1074353864
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2 -0.0058215793 0.0040229829
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3 0.3140859414 -0.2167982981
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|
4 -0.0487094652 0.0336230331
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5 0.0515095412 -0.0355593666
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6 0.0152611447 0.1884571248
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7 0.0005721457 0.0070468898
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8 0.0307206070 0.3804015924
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|
9 -0.0047647264 -0.0589881426
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10 0.0050519645 0.0623833454
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11 -0.1325461422 0.0915375308
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|
12 -0.0048754330 0.0033623536
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13 0.2546844757 -0.1757950833
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|
14 0.0241724064 -0.0166873920
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|
15 0.0215485087 -0.0148876059
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|
16 0.0129758483 0.1605742473
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|
17 0.0004755059 0.0059024529
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|
18 0.0249129946 0.3084683299
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|
19 0.0023638481 0.0292863737
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|
20 0.0021085617 0.0261171188
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|
|
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orbital 1 3 89 5.7535771883 0.0000000000
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1 0.0374311531 -0.1004613286
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2 0.0345067344 -0.0925963636
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3 -0.0779061874 0.2090663730
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4 0.0444498084 -0.1192998003
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5 -0.0493675610 0.1324666318
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6 -0.0682733995 -0.0826509638
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7 -0.0629289164 -0.0761769033
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8 -0.1420804070 -0.1719956295
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9 0.0810812683 0.0981367387
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|
10 -0.0900601018 -0.1089969492
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11 -0.0486551385 0.1305735698
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|
12 0.0404257798 -0.1084772016
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13 0.0998104681 -0.2678581575
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|
14 0.0523753221 -0.1405464557
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|
15 0.0540982566 -0.1451806949
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16 0.0887421000 0.1074291183
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|
17 -0.0737226284 -0.0892455691
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|
18 0.1820403844 0.2203644410
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|
19 0.0955154331 0.1156224935
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|
20 0.0986732704 0.1194222877
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|
|
|
orbital 1 3 90 5.8535164811 0.0000000000
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1 -0.0498899989 0.2550749544
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2 -0.0213638477 0.1091460882
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3 0.0004564120 -0.0023708514
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|
4 0.0079045863 -0.0405180091
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5 0.0323864638 -0.1655509254
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6 -0.1959460564 -0.1708046525
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7 -0.0838201192 -0.0730769070
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8 -0.0017790308 -0.0015505292
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|
9 -0.0311048221 -0.0271236071
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10 -0.1271753525 -0.1108210539
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11 -0.0611436143 0.3121933903
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|
12 0.0231543876 -0.1183038157
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13 0.0005336553 -0.0028402679
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|
14 -0.0071439837 0.0365007669
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|
15 0.0384343077 -0.1963782805
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|
16 -0.2398339500 -0.2089470239
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|
17 0.0909109344 0.0792013254
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|
18 -0.0021863725 -0.0019320787
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19 0.0280085449 0.0244169555
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|
20 -0.1508250267 -0.1314286441
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|
|
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orbital 1 3 91 5.9331871540 0.0000000000
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1 0.2283338579 0.0716449118
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2 0.0540693617 0.0169364282
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3 0.1382062384 0.0433891054
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|
4 -0.1029248782 -0.0322783793
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5 -0.1162299535 -0.0364508186
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6 0.1762198002 -0.1618789111
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7 0.0417012927 -0.0383029486
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8 -0.1066737279 0.0979723951
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9 0.0794172716 -0.0729799027
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10 0.0896991778 -0.0823623415
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11 -0.2735287200 -0.0858742316
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12 0.0644450640 0.0202332717
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13 -0.1698150066 -0.0532945468
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14 -0.1141936220 -0.0358650975
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15 0.1357458664 0.0426467772
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17 0.0497330526 -0.0457416622
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18 0.1310642612 -0.1204152090
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19 0.0881459178 -0.0809904041
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20 -0.1048041102 0.0962958814
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|
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orbital 1 3 92 6.3355897701 0.0000000000
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1 0.0431340395 0.0276089038
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2 -0.0580544345 -0.0371733679
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3 0.2100773465 0.1344955340
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4 -0.1714287865 -0.1097468233
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5 0.0360108155 0.0230385128
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6 -0.0454780966 0.0235548401
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7 0.0612256166 -0.0317055181
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8 0.2215419004 -0.1147212835
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9 -0.1807317458 0.0935902089
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10 0.0379702693 -0.0196456832
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11 -0.0418546010 -0.0267958337
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|
12 -0.0670413846 -0.0429245858
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13 -0.2463271625 -0.1577035974
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14 -0.1885806216 -0.1207426600
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15 -0.0309013415 -0.0197662528
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17 0.0707072164 -0.0366204195
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19 -0.1988590862 0.1029786729
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20 -0.0325457979 0.0168533936
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orbital 1 3 93 9.9376536145 0.0000000000
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1 0.0159405315 0.0077875872
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2 0.0252456871 0.0124018122
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3 0.0197851080 0.0078737356
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|
4 0.0305261612 0.0125020561
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5 0.0281900732 0.0134943518
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6 -0.0134546024 0.0103333991
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7 -0.0222546818 0.0166950671
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8 0.0179487441 -0.0106677849
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|
9 0.0260315143 -0.0173313701
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10 0.0235140231 -0.0188637108
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11 0.0144210246 0.0062733277
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12 -0.0250042177 -0.0117217122
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13 0.0272607612 0.0124773803
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14 -0.0183139202 -0.0073606469
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15 0.0260670997 0.0114208252
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16 -0.0136953028 0.0077710566
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17 0.0233478875 -0.0142939136
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18 0.0236512669 -0.0167885511
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|
19 -0.0170435730 0.0113177790
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20 0.0231572476 -0.0148052566
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orbital 1 3 94 9.9773093023 0.0000000000
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1 -0.0116153278 -0.0147687020
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2 -0.0044657600 -0.0061699096
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3 0.0023030432 0.0019827473
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4 0.0001103274 -0.0014611224
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5 -0.0124005078 -0.0157006258
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6 -0.0182487538 0.0045002149
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8 0.0142166679 -0.0048513962
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|
9 -0.0063827190 0.0021780897
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|
10 0.0057095674 -0.0019482668
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|
11 -0.0034404448 -0.0030072510
|
|
12 0.0049424181 0.0043204114
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|
13 0.0100153737 0.0087551763
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|
14 0.0050873896 0.0044473701
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15 0.0025439831 0.0022237949
|
|
16 0.0043246009 -0.0014756547
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|
17 -0.0062127890 0.0021199935
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|
18 0.0125897011 -0.0042960608
|
|
19 0.0063951687 -0.0021822545
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20 0.0031978185 -0.0010911649
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|
|
|
orbital 1 4 28 -13.2598243544 1.0000000000
|
|
1 -0.0000447007 0.0005407278
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3 0.0012803366 -0.0154819004
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|
4 -0.0006287768 0.0076029034
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5 0.0002514621 -0.0030396321
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6 0.0004458733 0.0003090182
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7 0.0000929298 0.0000643865
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8 0.0127682385 0.0088487331
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|
9 -0.0062702957 -0.0043454296
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10 0.0025068412 0.0017373130
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11 0.0000586574 -0.0007106455
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|
12 -0.0004947433 0.0059822640
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13 -0.0030903568 0.0373646732
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14 -0.0016432254 0.0198685568
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|
15 -0.0004259316 0.0051505225
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|
16 -0.0005863229 -0.0004057810
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17 0.0049337002 0.0034192330
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|
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|
19 -0.0163856815 -0.0113564632
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20 -0.0042478234 -0.0029437610
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|
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orbital 1 4 29 -13.1774104435 1.0000000000
|
|
1 -0.0023492326 0.0005142467
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5 0.0041326009 -0.0009046067
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6 0.0007294253 -0.0022917239
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8 0.0045803554 -0.0143996090
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|
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|
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|
17 0.0012983335 -0.0040812002
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|
18 -0.0051169651 0.0160865990
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20 -0.0018872870 0.0059328391
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|
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orbital 1 4 30 -13.1513867992 1.0000000000
|
|
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3 0.0184609189 0.0116920677
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|
4 -0.0112294340 -0.0071119613
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6 0.0190272324 -0.0099699872
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9 0.0117738099 -0.0061691037
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11 0.0257354886 0.0162989314
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|
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|
17 -0.0035107192 0.0018395704
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|
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19 -0.0148011435 0.0077552825
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20 0.0120546270 -0.0063165150
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|
|
|
orbital 1 4 31 -13.0751441656 1.0000000000
|
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1 -0.0083762756 0.0079519363
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3 -0.0202941203 0.0192669984
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|
4 0.0113293624 -0.0107558346
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5 0.0020482297 -0.0019445453
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6 0.0026986801 0.0112298904
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|
9 0.0036497082 0.0151896528
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|
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|
15 0.0034551743 -0.0032800024
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|
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|
17 0.0007397040 0.0030793829
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|
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|
19 -0.0057693942 -0.0240127484
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20 0.0011132871 0.0046321411
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|
|
|
orbital 1 4 32 -12.8756510273 1.0000000000
|
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1 -0.0181842874 0.0288468909
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3 -0.0019094362 0.0030265461
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|
4 0.0025640248 -0.0040661813
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5 0.0085231645 -0.0135213558
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6 0.0158859305 0.0301735273
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7 0.0047586308 0.0090391904
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8 -0.0016683480 -0.0031658683
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|
9 0.0022400997 0.0042533561
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11 0.0125875390 -0.0199733638
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12 -0.0033000306 0.0052362982
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13 0.0032976403 -0.0052345404
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|
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|
17 0.0028829396 0.0054770187
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18 0.0028802181 0.0054751348
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|
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|
20 -0.0053556174 -0.0101745741
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|
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orbital 1 4 33 -12.8515348432 1.0000000000
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3 -0.0474233957 0.0097210399
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4 0.0251060306 -0.0051463626
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6 0.0024943736 -0.0074919697
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|
9 0.0080958637 -0.0243156688
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14 -0.0367387134 0.0075313016
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|
15 0.0060140329 -0.0012338602
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|
16 0.0084919521 -0.0254981561
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17 0.0012306287 -0.0036985693
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|
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20 0.0019405479 -0.0058245449
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|
|
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orbital 1 4 34 -12.7990900969 1.0000000000
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3 0.0012099187 -0.0001332862
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8 0.0004879904 -0.0011151448
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12 0.0104090204 -0.0011597737
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15 0.0165337017 -0.0018429660
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|
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|
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20 0.0066697466 -0.0152405318
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|
|
|
orbital 1 4 35 -12.7783779018 1.0000000000
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1 0.0052527861 -0.0041371660
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3 0.0158037871 -0.0124540801
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|
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7 -0.0002830618 -0.0019575671
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|
8 -0.0028809468 -0.0199137713
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|
9 0.0015277416 0.0105600935
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10 0.0001430148 0.0009881443
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|
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|
12 0.0183481050 -0.0144582166
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13 0.0176610533 -0.0139179220
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14 0.0061402600 -0.0048391685
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|
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|
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|
17 0.0033441495 0.0231193689
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|
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|
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20 -0.0040206315 -0.0277973324
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|
|
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orbital 1 4 36 -12.7446552144 1.0000000000
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1 -0.0247201515 0.0208465255
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3 0.0130709085 -0.0110212588
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4 -0.0042009840 0.0035419269
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5 0.0132414341 -0.0111663777
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6 0.0056895737 0.0318322027
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7 0.0026295592 0.0147108639
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8 0.0030091156 0.0168305245
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|
9 -0.0009673240 -0.0054091112
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12 0.0179684640 -0.0151519893
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13 0.0168933848 -0.0142445785
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14 0.0056718493 -0.0047823261
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|
15 0.0219945600 -0.0185471667
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16 0.0092541485 0.0517672234
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|
17 -0.0041363102 -0.0231375091
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|
18 0.0038891090 0.0217525591
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|
19 0.0013058506 0.0073030808
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20 0.0050630810 0.0283218949
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|
|
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orbital 1 4 37 -1.9370371718 1.0000000000
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1 -0.0081866919 0.0139365282
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2 0.0203175423 -0.0345868901
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3 -0.0371104569 0.0631734087
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4 0.0271410249 -0.0462025605
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5 -0.0013655955 0.0023243999
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6 -0.0079759907 -0.0140581061
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7 0.0197946835 0.0348888485
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8 0.0361550821 0.0637253133
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|
9 -0.0264422466 -0.0466056589
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10 0.0013305316 0.0023451099
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11 0.0113196008 -0.0192697565
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12 0.0227758965 -0.0387719399
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13 0.0413949587 -0.0704676393
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14 0.0327293143 -0.0557155892
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15 0.0020014681 -0.0034070151
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17 0.0221892859 0.0391099795
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|
18 -0.0403291444 -0.0710822706
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19 -0.0318867374 -0.0562020803
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20 -0.0019497708 -0.0034368966
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|
|
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orbital 1 4 38 -1.6979996076 1.0000000000
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1 0.0183294632 0.0159011376
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2 0.0106208241 0.0092135597
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3 -0.0328137521 -0.0284655112
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|
4 0.0102268725 0.0088708632
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5 0.0336379577 0.0291813811
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6 0.0229356654 -0.0079233719
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7 0.0132896415 -0.0045912542
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8 0.0410585751 -0.0141850618
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10 -0.0420906451 0.0145409955
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11 0.0471552048 0.0409078450
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12 0.0446912052 0.0387695087
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13 0.1184078832 0.1027189411
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14 0.1445181123 0.1253698805
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15 0.0404351917 0.0350779429
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20 -0.0505957392 0.0174793868
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|
|
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orbital 1 4 39 -1.6326548916 1.0000000000
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1 -0.0344819738 -0.0378996399
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2 0.0284556225 0.0312748249
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3 -0.0939318287 -0.1032390718
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4 0.1044603325 0.1148125762
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5 -0.0317969621 -0.0349480383
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6 -0.0500630411 0.0109135456
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7 0.0413130807 -0.0090059851
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8 0.1363732246 -0.0297281633
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|
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|
10 0.0461642907 -0.0100633553
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11 -0.0179948519 -0.0197791023
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|
12 0.0271080296 0.0297937617
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13 0.0689033495 0.0757302765
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15 -0.0369016885 -0.0405579016
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|
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17 0.0393558114 -0.0085795839
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|
18 -0.1000356328 0.0218073648
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20 0.0535749465 -0.0116788758
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|
|
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orbital 1 4 40 -1.1871158158 1.0000000000
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1 0.0080836882 -0.0334779093
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2 -0.0274750520 0.1137831705
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3 0.0084920343 -0.0351673782
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4 -0.0062576968 0.0259168388
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5 -0.0224889482 0.0931350680
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6 -0.0249506794 -0.0237401926
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7 0.0848024135 0.0806851203
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8 0.0262098770 0.0249376604
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|
9 -0.0193154685 -0.0183782738
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|
10 -0.0694130631 -0.0660435468
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12 0.0316514755 -0.1310783388
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|
13 -0.0004781507 0.0019806229
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18 -0.0014759387 -0.0014051713
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|
20 -0.1096640628 -0.1043407194
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|
|
|
orbital 1 4 41 -0.9852351342 1.0000000000
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1 0.0194731153 -0.0172281747
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2 0.0017956944 -0.0015881000
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3 0.0525271308 -0.0464756862
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|
4 -0.0092518883 0.0081850939
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5 -0.0283500184 0.0250821847
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6 0.0051834725 0.0254782776
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|
7 0.0004773507 0.0023486817
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8 -0.0139849981 -0.0687282336
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|
9 0.0024629342 0.0121047618
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|
10 0.0075469901 0.0370920231
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|
12 -0.0478881286 0.0423686840
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|
17 -0.0127490378 -0.0626553400
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|
18 0.0259686141 0.1276220623
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20 0.0219450965 0.1078463558
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|
|
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orbital 1 4 42 -0.9004422072 1.0000000000
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1 0.0914878842 0.0259924679
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2 0.0314445966 0.0089306415
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3 -0.1068060424 -0.0303456886
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|
4 0.0059818183 0.0017037719
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5 0.0105010167 0.0029875293
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6 0.0682607221 -0.0662274532
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7 0.0234619214 -0.0227608841
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8 0.0796898019 -0.0773167495
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12 -0.0615785703 -0.0174938125
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|
13 -0.1251683824 -0.0355651232
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14 0.0236569975 0.0067159029
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18 0.0933885100 -0.0906114248
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20 0.0074595561 -0.0072349882
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3 0.1395648769 -0.0538858218
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4 0.0318974991 -0.0123132726
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5 0.0954519079 -0.0368484588
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6 0.0152223319 -0.0972854191
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7 0.0166251040 -0.1062805068
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8 0.0231243567 -0.1478075195
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|
9 0.0052841275 -0.0337795100
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|
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|
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20 0.0067759214 -0.0433053908
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orbital 1 4 44 -0.8125261282 1.0000000000
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1 -0.0798509172 -0.0180585430
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2 0.0403791927 0.0091318977
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3 -0.1094752621 -0.0247606756
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|
4 0.1765817722 0.0399383596
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5 -0.0507441207 -0.0114771061
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6 0.0555657716 -0.0601227320
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8 -0.0761794716 0.0824313787
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11 -0.0608090032 -0.0137491363
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12 0.0529672774 0.0119797043
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13 0.2340602282 0.0529362609
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|
14 0.0542396882 0.0122671085
|
|
15 0.0666633372 0.0150754954
|
|
16 0.0423159845 -0.0457832946
|
|
17 -0.0368578259 0.0398793171
|
|
18 0.1628744333 -0.1762329296
|
|
19 0.0377432036 -0.0408404928
|
|
20 0.0463879725 -0.0501936925
|
|
|
|
orbital 1 4 45 -0.6968636421 1.0000000000
|
|
1 0.0819197673 0.0524871192
|
|
2 -0.0625862219 -0.0400865727
|
|
3 -0.0269808977 -0.0172821020
|
|
4 0.0506020695 0.0324152038
|
|
5 -0.0753592644 -0.0482999554
|
|
6 -0.0864166470 0.0446976539
|
|
7 0.0660194423 -0.0341340912
|
|
8 -0.0284614051 0.0147134280
|
|
9 0.0533808781 -0.0276002233
|
|
10 -0.0795002799 0.0411327731
|
|
11 0.1496763737 0.0958952094
|
|
12 0.1087151807 0.0696449662
|
|
13 0.0527902508 0.0338433535
|
|
14 -0.0047328306 -0.0030154917
|
|
15 -0.1149766426 -0.0736796735
|
|
16 -0.1578928061 0.0816603434
|
|
17 -0.1146824514 0.0593030737
|
|
18 0.0556961611 -0.0288198109
|
|
19 -0.0049881212 0.0025648834
|
|
20 -0.1212913063 0.0627458926
|
|
|
|
orbital 1 4 46 -0.6847349832 1.0000000000
|
|
1 -0.0130560426 -0.0052171968
|
|
2 0.1033364367 0.0413956052
|
|
3 0.0447262823 0.0179153688
|
|
4 -0.0647779321 -0.0259466786
|
|
5 -0.0808991787 -0.0324268452
|
|
6 -0.0110634375 0.0086792513
|
|
7 0.0875281665 -0.0687835576
|
|
8 -0.0378839712 0.0297684404
|
|
9 0.0548692427 -0.0431157457
|
|
10 0.0685162038 -0.0538650803
|
|
11 -0.0584836844 -0.0234089826
|
|
12 -0.1136617406 -0.0455236502
|
|
13 0.0849208277 0.0340335750
|
|
14 0.1035133068 0.0414750521
|
|
15 -0.0541435906 -0.0217116525
|
|
16 -0.0495461850 0.0389099624
|
|
17 -0.0962762282 0.0756506758
|
|
18 -0.0719246447 0.0565376897
|
|
19 -0.0876744549 0.0689091242
|
|
20 0.0458505482 -0.0360597238
|
|
|
|
orbital 1 4 47 -0.5909616870 1.0000000000
|
|
1 0.0348289333 -0.1249903060
|
|
2 0.0143115150 -0.0513596774
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|
3 -0.0257797437 0.0925156057
|
|
4 0.0086036898 -0.0308798219
|
|
5 -0.0358104243 0.1285109677
|
|
6 -0.0908317576 -0.0926566831
|
|
7 -0.0373232904 -0.0380737578
|
|
8 -0.0672326145 -0.0685819428
|
|
9 0.0224408195 0.0228909677
|
|
10 -0.0933904725 -0.0952660521
|
|
11 -0.0298719166 0.1072026066
|
|
12 0.0360671932 -0.1294341307
|
|
13 0.0134056943 -0.0481142645
|
|
14 0.0021530126 -0.0077259018
|
|
15 0.0443052115 -0.1589989469
|
|
16 0.0779045451 0.0794704840
|
|
17 -0.0940620478 -0.0959497691
|
|
18 0.0349650421 0.0356672096
|
|
19 0.0056145165 0.0057270044
|
|
20 0.1155467064 0.1178662957
|
|
|
|
orbital 1 4 48 -0.5539469263 1.0000000000
|
|
1 0.0284413311 0.0320007031
|
|
2 0.0193056207 0.0217215668
|
|
3 -0.0167435304 -0.0188392411
|
|
4 0.0495833958 0.0557894887
|
|
5 0.0454254197 0.0511148769
|
|
6 -0.0419339111 0.0086308438
|
|
7 -0.0284642968 0.0058579779
|
|
8 -0.0246864863 0.0050787276
|
|
9 0.0731076827 -0.0150435753
|
|
10 0.0669792525 -0.0137857681
|
|
11 -0.0089415481 -0.0100621406
|
|
12 -0.0572556741 -0.0644236612
|
|
13 0.0847664180 0.0953772328
|
|
14 0.0698980833 0.0786484733
|
|
15 -0.0980922538 -0.1103734007
|
|
16 0.0131840058 -0.0027141522
|
|
17 0.0844199768 -0.0173745323
|
|
18 0.1249818699 -0.0257205876
|
|
19 0.1030600015 -0.0212089150
|
|
20 -0.1446318091 0.0297660872
|
|
|
|
orbital 1 4 49 -0.4367298122 1.0000000000
|
|
1 0.0424765152 -0.0596779549
|
|
2 0.0592941706 -0.0833015445
|
|
3 0.1020388527 -0.1433510470
|
|
4 -0.0128565845 0.0180638918
|
|
5 -0.0471721877 0.0662713242
|
|
6 0.0304395139 0.0666265171
|
|
7 0.0424925294 0.0930016481
|
|
8 -0.0731264079 -0.1600439008
|
|
9 0.0092128454 0.0201673945
|
|
10 0.0338047789 0.0739886418
|
|
11 0.0784951770 -0.1102672879
|
|
12 -0.0775446732 0.1089376735
|
|
13 0.0735252399 -0.1032908861
|
|
14 -0.0549798773 0.0772405356
|
|
15 -0.0285594651 0.0401210353
|
|
16 0.0562545586 0.1231086307
|
|
17 -0.0555726012 -0.1216233139
|
|
18 -0.0526930647 -0.1153190331
|
|
19 0.0394010554 0.0862348636
|
|
20 0.0204681295 0.0447931204
|
|
|
|
orbital 1 4 50 -0.3999923913 1.0000000000
|
|
1 0.0282287833 -0.1730363700
|
|
2 0.0105064828 -0.0644111652
|
|
3 0.0057785461 -0.0354323580
|
|
4 -0.0166939609 0.1023273545
|
|
5 -0.0063078881 0.0386755771
|
|
6 -0.1357394273 -0.1109651931
|
|
7 -0.0505266143 -0.0413077432
|
|
8 0.0277935884 0.0227228261
|
|
9 -0.0802713039 -0.0656210819
|
|
10 -0.0303374323 -0.0248035544
|
|
11 -0.0373759796 0.2290944648
|
|
12 0.0078711190 -0.0482413327
|
|
13 -0.0148185880 0.0908182750
|
|
14 -0.0113522399 0.0695952188
|
|
15 0.0104233585 -0.0638977339
|
|
16 0.1797160882 0.1469129886
|
|
17 -0.0378446420 -0.0309354679
|
|
18 -0.0712445988 -0.0582366355
|
|
19 -0.0545936860 -0.0446315816
|
|
20 0.0501240170 0.0409770338
|
|
|
|
orbital 1 4 51 -0.2323927996 1.0000000000
|
|
1 0.0327865596 0.0469840910
|
|
2 -0.0111425854 -0.0159642525
|
|
3 -0.0299918571 -0.0429774694
|
|
4 0.0296553779 0.0424934531
|
|
5 -0.0367718099 -0.0526900067
|
|
6 0.0570828549 -0.0049084487
|
|
7 -0.0193973735 0.0016659237
|
|
8 0.0522161427 -0.0044866690
|
|
9 -0.0516276234 0.0044354519
|
|
10 0.0640172169 -0.0054997625
|
|
11 -0.0448824281 -0.0643135428
|
|
12 0.0125970479 0.0180501600
|
|
13 -0.0027495880 -0.0039381791
|
|
14 0.0374262697 0.0536308302
|
|
15 0.0465469109 0.0666940831
|
|
16 -0.0781368345 0.0067170346
|
|
17 0.0219302658 -0.0018863780
|
|
18 0.0047847821 -0.0004120335
|
|
19 -0.0651584846 0.0055990221
|
|
20 -0.0810322490 0.0069612311
|
|
|
|
orbital 1 4 52 -0.1499514183 1.0000000000
|
|
1 -0.0480519912 0.2101358665
|
|
2 -0.0168502364 0.0736853346
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|
3 0.0026081052 -0.0114008113
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|
4 0.0039256921 -0.0171655113
|
|
5 0.0000108138 -0.0000402912
|
|
6 -0.1579591837 -0.1466804453
|
|
7 -0.0553889368 -0.0514346179
|
|
8 -0.0085688850 -0.0079563061
|
|
9 -0.0129028614 -0.0119825277
|
|
10 -0.0000314773 -0.0000275334
|
|
11 0.0486638259 -0.2128084543
|
|
12 -0.0179332836 0.0784214386
|
|
13 -0.0032344271 0.0141477454
|
|
14 -0.0046545660 0.0203529130
|
|
15 0.0160703308 -0.0702888612
|
|
16 0.1599688566 0.1485449032
|
|
17 -0.0589509281 -0.0547399567
|
|
18 0.0106328282 0.0098747731
|
|
19 0.0152990274 0.0142057429
|
|
20 -0.0528351067 -0.0490651799
|
|
|
|
orbital 1 4 53 0.1114427914 1.0000000000
|
|
1 0.1117014383 0.1080875765
|
|
2 0.0313270149 0.0303132233
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|
3 0.0822899478 0.0796279531
|
|
4 0.0438411001 0.0424224479
|
|
5 -0.0155690800 -0.0150656912
|
|
6 0.1494573902 -0.0426934008
|
|
7 0.0419155169 -0.0119733949
|
|
8 -0.1101042339 0.0314521079
|
|
9 -0.0586596109 0.0167561162
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|
10 0.0208319374 -0.0059510463
|
|
11 0.0856974895 0.0829256955
|
|
12 -0.0233560190 -0.0226010950
|
|
13 0.1761174431 0.1704190211
|
|
14 -0.1103906590 -0.1068188352
|
|
15 0.0227005690 0.0219652050
|
|
16 0.1146640062 -0.0327553761
|
|
17 -0.0312505527 0.0089275607
|
|
18 -0.2356460248 0.0673136910
|
|
19 0.1477025776 -0.0421926050
|
|
20 -0.0303728627 0.0086756116
|
|
|
|
orbital 1 4 54 0.1579815846 1.0000000000
|
|
1 -0.0429740756 0.0873432353
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|
2 0.0292838843 -0.0595174543
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|
3 -0.0137411122 0.0279284675
|
|
4 -0.0023184511 0.0047133636
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|
5 0.0662226879 -0.1345937778
|
|
6 -0.0541543470 -0.0808879388
|
|
7 0.0369020855 0.0551199655
|
|
8 0.0173150648 0.0258637103
|
|
9 0.0029224250 0.0043653421
|
|
10 -0.0834513228 -0.1246466937
|
|
11 0.0244723359 -0.0497392214
|
|
12 0.0286728759 -0.0582769407
|
|
13 0.0042194075 -0.0085740621
|
|
14 0.0060137431 -0.0122220549
|
|
15 -0.0691960615 0.1406386382
|
|
16 0.0308399831 0.0460625608
|
|
17 0.0361323773 0.0539697484
|
|
18 -0.0053160038 -0.0079414784
|
|
19 -0.0075771808 -0.0113184985
|
|
20 0.0871992761 0.1302448012
|
|
|
|
orbital 1 4 55 0.8501381817 1.0000000000
|
|
1 -0.1513401476 -0.0959130805
|
|
2 -0.0370063441 -0.0234523534
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|
3 -0.0033598125 -0.0021283246
|
|
4 -0.0592577998 -0.0375545829
|
|
5 -0.0901916565 -0.0571601163
|
|
6 0.1587335809 -0.0831082534
|
|
7 0.0388133150 -0.0203215364
|
|
8 -0.0035240620 0.0018462724
|
|
9 -0.0621523938 0.0325412945
|
|
10 -0.0945994780 0.0495309249
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|
11 -0.1105250067 -0.0700457401
|
|
12 0.0174455937 0.0110554262
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|
13 -0.0568326556 -0.0360196982
|
|
14 0.0851000753 0.0539324982
|
|
15 -0.0725325483 -0.0459691264
|
|
16 0.1159238976 -0.0606941147
|
|
17 -0.0182944881 0.0095786694
|
|
18 -0.0596106551 0.0312108042
|
|
19 0.0892576916 -0.0467323266
|
|
20 -0.0760757282 0.0398318520
|
|
|
|
orbital 1 4 56 0.9140478520 1.0000000000
|
|
1 -0.0576006505 -0.0250027534
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|
2 0.0107849912 0.0046816009
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|
3 -0.2386705217 -0.1036023378
|
|
4 -0.0863384647 -0.0374765521
|
|
5 0.0583593981 0.0253325431
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|
6 -0.0504514458 0.0373816936
|
|
7 0.0094469224 -0.0069991785
|
|
8 0.2090564839 -0.1548951157
|
|
9 0.0756247892 -0.0560337397
|
|
10 -0.0511179049 0.0378743835
|
|
11 -0.0457073101 -0.0198409792
|
|
12 0.0164274085 0.0071312216
|
|
13 0.2118830624 0.0919734380
|
|
14 -0.0526008882 -0.0228322506
|
|
15 -0.0496281126 -0.0215425191
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|
16 -0.0400347679 0.0296626263
|
|
17 0.0143888703 -0.0106616134
|
|
18 -0.1855926012 0.1375092083
|
|
19 0.0460735305 -0.0341380237
|
|
20 0.0434708631 -0.0322079821
|
|
|
|
orbital 1 4 57 0.9873397598 1.0000000000
|
|
1 -0.1349428652 0.0858872048
|
|
2 -0.0591179227 0.0376278558
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|
3 -0.0328040853 0.0208787355
|
|
4 -0.1127420752 0.0717564384
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|
5 -0.1148916738 0.0731239584
|
|
6 0.0069094095 0.1598052565
|
|
7 0.0030282152 0.0700135841
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|
8 -0.0016797089 -0.0388484642
|
|
9 -0.0057721587 -0.1335154894
|
|
10 -0.0058827123 -0.1360614740
|
|
11 0.0841188090 -0.0535384586
|
|
12 -0.0591327180 0.0376361608
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|
13 0.0118469665 -0.0075411771
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|
14 -0.0857253691 0.0545609129
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|
15 0.1261831249 -0.0803110364
|
|
16 -0.0043077472 -0.0996220914
|
|
17 0.0030281717 0.0700278271
|
|
18 0.0006058699 0.0140267058
|
|
19 -0.0043885815 -0.1015210401
|
|
20 0.0064613427 0.1494323432
|
|
|
|
orbital 1 4 58 1.1172049086 1.0000000000
|
|
1 -0.0330701251 0.0130534160
|
|
2 0.0369485279 -0.0145843124
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|
3 0.0048068969 -0.0018967572
|
|
4 0.0691010212 -0.0272750023
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|
5 -0.0057758088 0.0022803056
|
|
6 -0.0052299819 0.0351656617
|
|
7 0.0058437664 -0.0392896958
|
|
8 -0.0007599206 0.0051108545
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|
9 -0.0109286210 0.0734808752
|
|
10 0.0009146033 -0.0061420481
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|
11 -0.0585081248 0.0230944597
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|
12 -0.0758636557 0.0299446192
|
|
13 -0.0404041431 0.0159477438
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|
14 0.0034077645 -0.0013459195
|
|
15 0.0017177938 -0.0006771200
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|
16 -0.0092527425 0.0622157970
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|
17 -0.0119984587 0.0806725532
|
|
18 0.0063909364 -0.0429658698
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|
19 -0.0005394304 0.0036247515
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|
20 -0.0002709372 0.0018265855
|
|
|
|
orbital 1 4 59 1.2795831308 1.0000000000
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|
1 0.0638530961 0.0875593721
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|
2 -0.0795853310 -0.1091065789
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|
3 0.0446488190 0.0611730425
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|
4 0.1005876805 0.1379036722
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|
5 -0.0074249854 -0.0101805914
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|
6 -0.1077544841 0.0115368756
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|
7 0.1342824549 -0.0143622533
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|
8 0.0753026067 -0.0080308980
|
|
9 0.1697228586 -0.0181528882
|
|
10 -0.0125297381 0.0013414742
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|
11 -0.0168330720 -0.0230628812
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|
12 -0.1041719510 -0.1428213522
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|
13 -0.0741622663 -0.1016926378
|
|
14 0.0655689397 0.0898891615
|
|
15 0.0103572714 0.0141931890
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|
16 0.0283893546 -0.0030261990
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|
17 0.1757729366 -0.0188020903
|
|
18 -0.1251478239 0.0133973749
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|
19 0.1106320761 -0.0118307148
|
|
20 0.0174705630 -0.0018644170
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|
|
|
orbital 1 4 60 1.2841637059 1.0000000000
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|
1 -0.0252796165 -0.0626989193
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|
2 -0.0122020312 -0.0301958416
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3 0.0743891338 0.1843611125
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|
4 0.0116653929 0.0288588009
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|
5 0.0048425651 0.0120104700
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|
6 -0.0669375474 -0.0094263807
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|
7 -0.0322525686 -0.0045667524
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|
8 -0.1968544145 -0.0277770040
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|
9 -0.0308223447 -0.0043700020
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|
10 -0.0128216413 -0.0018056446
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|
11 -0.0299301797 -0.0741786374
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|
12 -0.0005295188 -0.0012493025
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|
13 0.0251442971 0.0623677376
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|
14 0.0155603899 0.0385290902
|
|
15 0.0115494079 0.0286247257
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|
16 -0.0792031188 -0.0111739770
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|
17 -0.0013443539 -0.0002129856
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|
18 -0.0665831505 -0.0093754732
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|
19 -0.0411469222 -0.0058175747
|
|
20 -0.0305648669 -0.0043119707
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|
|
|
orbital 1 4 61 1.3688711109 1.0000000000
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|
1 -0.0396770872 0.0068706976
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2 -0.1113081083 0.0192733955
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3 0.1732328362 -0.0299939329
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|
4 -0.0519846707 0.0090004029
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|
5 -0.0335022388 0.0058002365
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|
6 0.0138897759 -0.0377957320
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|
7 0.0389631431 -0.1060313358
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|
8 0.0606387767 -0.1650212131
|
|
9 -0.0181982825 0.0495209632
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|
10 -0.0117273116 0.0319147574
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|
11 -0.0822197725 0.0142370812
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|
12 -0.0286104498 0.0049538954
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|
13 0.0928484358 -0.0160776661
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|
14 0.1155093192 -0.0200004910
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|
15 -0.0206543760 0.0035756797
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|
16 0.0287813131 -0.0783219994
|
|
17 0.0100146704 -0.0272558249
|
|
18 0.0325007322 -0.0884458422
|
|
19 0.0404336513 -0.1100335261
|
|
20 -0.0072299305 0.0196750218
|
|
|
|
orbital 1 4 62 1.5803342965 1.0000000000
|
|
1 0.0012609146 0.0005675848
|
|
2 0.0077647018 0.0034999523
|
|
3 -0.0952872664 -0.0429539861
|
|
4 0.0289346852 0.0130415548
|
|
5 0.1064698754 0.0479940847
|
|
6 -0.0011231976 0.0008070405
|
|
7 -0.0069133863 0.0049740418
|
|
8 -0.0848415028 0.0610433376
|
|
9 0.0257620585 -0.0185374232
|
|
10 0.0947990588 -0.0682099316
|
|
11 -0.0451224892 -0.0203402803
|
|
12 -0.1455262846 -0.0655999713
|
|
13 0.0475820841 0.0214493244
|
|
14 -0.0620187383 -0.0279581778
|
|
15 0.1296345902 0.0584359376
|
|
16 0.0401756776 -0.0289075833
|
|
17 0.1295738644 -0.0932282779
|
|
18 0.0423670749 -0.0304821150
|
|
19 -0.0552215387 0.0397327622
|
|
20 0.1154233114 -0.0830493002
|
|
|
|
orbital 1 4 63 1.6859475478 1.0000000000
|
|
1 -0.0120388951 -0.0259000495
|
|
2 0.0653553145 0.1405880795
|
|
3 0.0609003363 0.1309977376
|
|
4 0.0578213091 0.1243748307
|
|
5 0.0432225457 0.0929775506
|
|
6 0.0284493406 0.0025211349
|
|
7 -0.1544331728 -0.0136836501
|
|
8 0.1438963061 0.0127567491
|
|
9 0.1366224347 0.0121091359
|
|
10 0.1021302057 0.0090489304
|
|
11 0.0255080719 0.0548651736
|
|
12 0.0753370375 0.1620668180
|
|
13 -0.0832177284 -0.1790081868
|
|
14 0.0216839682 0.0466386234
|
|
15 0.0129220398 0.0278008858
|
|
16 -0.0602701214 -0.0053410907
|
|
17 -0.1780217982 -0.0157720196
|
|
18 -0.1966377214 -0.0174265397
|
|
19 0.0512314907 0.0045434516
|
|
20 0.0305377922 0.0027047452
|
|
|
|
orbital 1 4 64 1.7036100911 1.0000000000
|
|
1 -0.0233821311 -0.0313083075
|
|
2 0.0669677705 0.0896728691
|
|
3 -0.0051684992 -0.0069009071
|
|
4 -0.0129923836 -0.0173779355
|
|
5 0.0437948876 0.0586420124
|
|
6 -0.0388035369 0.0046009238
|
|
7 0.1111396557 -0.0131823226
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|
8 0.0085649458 -0.0010052107
|
|
9 0.0215492016 -0.0025462844
|
|
10 -0.0726804450 0.0086198348
|
|
11 0.0074448091 0.0099713553
|
|
12 0.0990109258 0.1325705916
|
|
13 -0.0456324267 -0.0611097729
|
|
14 -0.0336185771 -0.0450032958
|
|
15 0.0172208825 0.0230597404
|
|
16 0.0123575687 -0.0014669927
|
|
17 0.1643109864 -0.0194820791
|
|
18 0.0757344754 -0.0089863066
|
|
19 0.0557838136 -0.0066072556
|
|
20 -0.0285804155 0.0033889382
|
|
|
|
orbital 1 4 65 1.8177764137 1.0000000000
|
|
1 0.0392994986 -0.0422897087
|
|
2 -0.1355646643 0.1458768634
|
|
3 -0.0640238526 0.0688972017
|
|
4 0.0430701885 -0.0463434947
|
|
5 -0.0066894299 0.0072013060
|
|
6 -0.0169712625 -0.0551783867
|
|
7 0.0585448223 0.1903409336
|
|
8 -0.0276492884 -0.0898958182
|
|
9 0.0186015197 0.0604720756
|
|
10 -0.0028889353 -0.0093941025
|
|
11 -0.0174263791 0.0187520529
|
|
12 -0.1189638514 0.1280110598
|
|
13 0.0069400486 -0.0074678633
|
|
14 0.0545750034 -0.0587232956
|
|
15 0.0255157307 -0.0274573706
|
|
16 0.0075261057 0.0244699055
|
|
17 0.0513796110 0.1670299181
|
|
18 0.0029963819 0.0097468965
|
|
19 0.0235705373 0.0766250126
|
|
20 0.0110193681 0.0358267504
|
|
|
|
orbital 1 4 66 1.9398671528 1.0000000000
|
|
1 -0.0163889981 -0.0619469451
|
|
2 0.0447463822 0.1691380351
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3 0.0374206268 0.1414469141
|
|
4 -0.0071593832 -0.0270560432
|
|
5 0.0055041675 0.0208059757
|
|
6 0.0618413105 0.0167832213
|
|
7 -0.1688506869 -0.0458203936
|
|
8 0.1412084490 0.0383184504
|
|
9 -0.0270097097 -0.0073299512
|
|
10 0.0207712648 0.0056368504
|
|
11 -0.0016876653 -0.0063807115
|
|
12 -0.0124300066 -0.0469906241
|
|
13 0.0031608446 0.0119478002
|
|
14 0.0221232415 0.0836272626
|
|
15 -0.0116896835 -0.0441867103
|
|
16 0.0063689480 0.0017290092
|
|
17 0.0469085133 0.0127279344
|
|
18 0.0119293855 0.0032382514
|
|
19 0.0834839803 0.0226523599
|
|
20 -0.0441121141 -0.0119701604
|
|
|
|
orbital 1 4 67 2.0682396957 1.0000000000
|
|
1 -0.0272574796 -0.0194638339
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|
2 -0.0835649672 -0.0596746734
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3 -0.0263184904 -0.0187943379
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|
4 0.0827456611 0.0590905554
|
|
5 -0.0147330400 -0.0105226605
|
|
6 0.0304866973 -0.0138716796
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|
7 0.0934634363 -0.0425284755
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|
8 -0.0294361339 0.0133943960
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|
9 0.0925471687 -0.0421135903
|
|
10 -0.0164808097 0.0075015674
|
|
11 -0.0196533069 -0.0140337571
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|
12 0.0350763581 0.0250446000
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|
13 -0.0235807297 -0.0168426230
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|
14 -0.0556069642 -0.0397105747
|
|
15 -0.0150893801 -0.0107760625
|
|
16 0.0219806010 -0.0100010122
|
|
17 -0.0392288175 0.0178509240
|
|
18 -0.0263764547 0.0120056036
|
|
19 -0.0621934574 0.0283020893
|
|
20 -0.0168773129 0.0076819505
|
|
|
|
orbital 1 4 68 2.1323686399 1.0000000000
|
|
1 0.0438316486 0.1390104905
|
|
2 0.0410041780 0.1300373711
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|
3 0.0058318708 0.0184947538
|
|
4 -0.0421986478 -0.1338321918
|
|
5 -0.0337140178 -0.1069253080
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|
6 0.1423012047 0.0315441740
|
|
7 0.1331184391 0.0295103615
|
|
8 -0.0189336480 -0.0041963867
|
|
9 0.1370013656 0.0303704358
|
|
10 0.1094571729 0.0242631528
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|
11 0.0302202531 0.0958428774
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|
12 -0.0216322039 -0.0686071745
|
|
13 -0.0017525969 -0.0055613322
|
|
14 0.0357666732 0.1134360529
|
|
15 -0.0337453166 -0.1070228555
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|
16 0.0981123752 0.0217478904
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|
17 -0.0702303538 -0.0155700122
|
|
18 0.0056924152 0.0012615276
|
|
19 -0.1161216023 -0.0257417184
|
|
20 0.1095582464 0.0242854568
|
|
|
|
orbital 1 4 69 2.2573368319 1.0000000000
|
|
1 -0.0261728238 -0.1010119676
|
|
2 -0.0326056042 -0.1258762963
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3 -0.0088734100 -0.0342601493
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|
4 0.0095028880 0.0366765479
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|
5 0.0313234977 0.1208961120
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|
6 0.1005653551 0.0278425253
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|
7 0.1253185046 0.0346908785
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|
8 -0.0341080133 -0.0094419154
|
|
9 0.0365133947 0.0101079766
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|
10 0.1203625933 0.0333222691
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|
11 0.0163633449 0.0631520468
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|
12 -0.0298447236 -0.1152150040
|
|
13 0.0014980685 0.0057823946
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|
14 0.0026583046 0.0102688356
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|
15 -0.0286177628 -0.1104508972
|
|
16 -0.0628710586 -0.0174095068
|
|
17 0.1147027351 0.0317497224
|
|
18 0.0057569388 0.0015916576
|
|
19 0.0102235062 0.0028289622
|
|
20 -0.1099605662 -0.0304444133
|
|
|
|
orbital 1 4 70 2.3959941525 1.0000000000
|
|
1 -0.0023707722 0.1145974818
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2 0.0048686898 -0.2351252349
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3 0.0005266377 -0.0253951528
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|
4 -0.0002728361 0.0131754889
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|
5 0.0004417043 -0.0213949623
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|
6 0.0980574191 0.0593515872
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|
7 -0.2011906380 -0.1217723840
|
|
8 0.0217297270 0.0131514943
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|
9 -0.0112754548 -0.0068231264
|
|
10 0.0183059022 0.0110807119
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|
11 0.0024708044 -0.1194883719
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|
12 0.0052256109 -0.2524162784
|
|
13 -0.0008482115 0.0410261855
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|
14 0.0001053884 -0.0051491510
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|
15 -0.0014020388 0.0678724671
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|
16 -0.1022434048 -0.0618886220
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|
17 -0.2159873659 -0.1307293615
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|
18 -0.0351066124 -0.0212506288
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|
19 0.0044069360 0.0026689943
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|
20 -0.0580746871 -0.0351543955
|
|
|
|
orbital 1 4 71 2.4777108896 1.0000000000
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1 0.0377953402 -0.0068568640
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2 -0.0819106976 0.0148561671
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|
3 -0.0447652876 0.0081194010
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|
4 -0.0540503402 0.0098047641
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|
5 -0.0506204627 0.0091798852
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|
6 -0.0129596455 0.0361632658
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|
7 0.0280875539 -0.0783649389
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|
8 -0.0153483659 0.0428304633
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|
9 -0.0185367315 0.0517109358
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|
10 -0.0173573525 0.0484369222
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|
11 0.0064476508 -0.0011717715
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|
12 0.0194489708 -0.0035292229
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|
13 -0.0160276398 0.0029070936
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|
14 0.0407878090 -0.0074000223
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|
15 -0.0704664988 0.0127803608
|
|
16 -0.0022109143 0.0061703760
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|
17 -0.0066678247 0.0185980346
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|
18 -0.0055002457 0.0153404931
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|
19 0.0139850063 -0.0390223281
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|
20 -0.0241621055 0.0674177559
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|
|
|
orbital 1 4 72 2.6771015310 1.0000000000
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|
1 -0.0063461474 -0.0163178821
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2 0.0091051932 0.0234063211
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3 0.0185536057 0.0477018744
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|
4 -0.0102367980 -0.0263185952
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|
5 0.0567848558 0.1460036637
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|
6 -0.0173117931 -0.0026650177
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|
7 0.0248290590 0.0038199160
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|
8 -0.0505911629 -0.0077844592
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|
9 0.0279102653 0.0042970699
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|
10 -0.1548355960 -0.0238256525
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|
11 0.0147072799 0.0378128337
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|
12 0.0090737983 0.0233315883
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|
13 0.0049896608 0.0128249700
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|
14 0.0190830722 0.0490654505
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|
15 0.0686708962 0.1765672754
|
|
16 0.0400922284 0.0061658941
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|
17 0.0247442154 0.0038050285
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|
18 -0.0136075156 -0.0020928836
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|
19 -0.0520320698 -0.0080095971
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|
20 -0.1872478579 -0.0288130771
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|
|
|
orbital 1 4 73 3.0975914955 1.0000000000
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|
1 -0.0508898993 0.0554877501
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|
2 0.0326791512 -0.0356333556
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3 -0.1529254979 0.1667478564
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|
4 -0.0931348284 0.1015544464
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|
5 -0.0332158592 0.0362157154
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|
6 -0.0226085303 -0.0718149786
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|
7 0.0145194008 0.0461180482
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|
8 0.0679436239 0.2158139360
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|
9 0.0413768884 0.1314357626
|
|
10 0.0147589955 0.0468722709
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|
11 -0.0984337772 0.1073299539
|
|
12 -0.0687016547 0.0749101121
|
|
13 0.0991802875 -0.1081430556
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|
14 -0.2508059786 0.2734765695
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|
15 -0.1750985945 0.1909272642
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|
16 -0.0437305699 -0.1389123881
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|
17 -0.0305227923 -0.0969540484
|
|
18 -0.0440650775 -0.1399651522
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|
19 0.1114291048 0.3539437111
|
|
20 0.0777937799 0.2471050872
|
|
|
|
orbital 1 4 74 3.1736282969 1.0000000000
|
|
1 0.1308249827 0.0505601283
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2 0.0457057032 0.0176358137
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3 -0.0869694248 -0.0335987437
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|
4 -0.0207602085 -0.0080618302
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|
5 0.2764430413 0.1068235542
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|
6 0.1091610346 -0.0880488058
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|
7 0.0381541320 -0.0307402469
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|
8 0.0725741221 -0.0585226210
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|
9 0.0172982398 -0.0139983936
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|
10 -0.2306712866 0.1860435524
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|
11 -0.1870125892 -0.0722136403
|
|
12 -0.0508262413 -0.0196190901
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|
13 0.0900025289 0.0347861731
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|
14 -0.2177476340 -0.0841113392
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|
15 -0.3480091639 -0.1343961236
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|
16 -0.1560798910 0.1258205196
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|
17 -0.0424242293 0.0341902719
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|
18 -0.0750943606 0.0605757328
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|
19 0.1817137398 -0.1465201859
|
|
20 0.2904397096 -0.2341492603
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|
|
|
orbital 1 4 75 3.1764204440 1.0000000000
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|
1 -0.1810951932 0.0629892456
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2 0.1367589121 -0.0475877594
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|
3 0.0413181676 -0.0143640237
|
|
4 0.3112951064 -0.1083037332
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|
5 -0.3011609725 0.1047419085
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|
6 0.0359658341 -0.1883439443
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|
7 -0.0271804519 0.1422263856
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|
8 0.0081978185 -0.0429758126
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|
9 0.0618516922 -0.3237423707
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|
10 -0.0598038872 0.3132145927
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|
11 -0.1633757731 0.0568687050
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|
12 -0.0980394234 0.0341175292
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|
13 -0.1611022469 0.0560387207
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|
14 0.0261196215 -0.0090573015
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|
15 -0.2047609245 0.0712889609
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|
16 0.0324843559 -0.1699036426
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|
17 0.0194871949 -0.1019577427
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|
18 -0.0320005980 0.1675487328
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|
19 0.0051621242 -0.0271691741
|
|
20 -0.0407295704 0.2129371253
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|
|
|
orbital 1 4 76 3.2964485554 1.0000000000
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|
1 -0.0953175217 0.0508953904
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2 0.1920619066 -0.1025494315
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3 0.0159140927 -0.0084986281
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|
4 0.3323867926 -0.1774751727
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|
5 -0.1583237454 0.0845365956
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|
6 -0.0035854546 0.1079955236
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|
7 0.0072201855 -0.2176058652
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|
8 -0.0005990482 0.0180283275
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|
9 -0.0124958175 0.3765923774
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|
10 0.0059522460 -0.1793783445
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|
11 0.0223292467 -0.0119218619
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|
12 -0.1472438390 0.0786182567
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13 0.0054664098 -0.0029198886
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|
14 -0.3097446849 0.1653836291
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|
15 0.0490151410 -0.0261704184
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|
16 0.0008371442 -0.0252936765
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|
17 -0.0055370681 0.1668265042
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|
18 -0.0002027628 0.0062035395
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19 0.0116450980 -0.3509377147
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|
20 -0.0018430190 0.0555361125
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|
|
|
orbital 1 4 77 3.4451052282 1.0000000000
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|
1 -0.0805479596 -0.0805357933
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2 0.1433866320 0.1433629558
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3 -0.0252278288 -0.0252229201
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|
4 -0.1343822305 -0.1343613539
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|
5 0.0057745259 0.0057750615
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|
6 -0.1100223115 0.0294884762
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|
7 0.1958513261 -0.0524917380
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|
8 0.0344572484 -0.0092363537
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|
9 0.1835529599 -0.0491963242
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|
10 -0.0078897678 0.0021111974
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|
11 0.0946228843 0.0946067972
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|
12 0.1819862933 0.1819590748
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|
13 0.0277385163 0.0277346920
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|
14 -0.1016707162 -0.1016518420
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|
15 0.0218738677 0.0218689267
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|
16 0.1292414138 -0.0346398617
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|
17 0.2485766632 -0.0666200410
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|
18 -0.0378905530 0.0101558622
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19 0.1388691123 -0.0372216922
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|
20 -0.0298760976 0.0080077127
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|
|
|
orbital 1 4 78 3.5237611946 1.0000000000
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|
1 -0.0605506977 -0.0182158396
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2 -0.1439905087 -0.0433200046
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3 0.0054824767 0.0016487099
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|
4 -0.3247485800 -0.0976982974
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|
5 -0.0998418982 -0.0300336261
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|
6 0.0460501950 -0.0433305208
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|
7 0.1095132125 -0.1030426992
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|
8 0.0041713253 -0.0039269113
|
|
9 -0.2469801996 0.2323891648
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|
10 -0.0759319045 0.0714458085
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|
11 -0.0951446220 -0.0286241103
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|
12 0.0812326256 0.0244397505
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|
13 0.0081094576 0.0024419254
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|
14 0.3092572654 0.0930371588
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|
15 -0.1869905235 -0.0562549943
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|
16 0.0723614081 -0.0680867960
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|
17 -0.0617830372 0.0581363151
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|
18 0.0061717448 -0.0058056539
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|
19 0.2352011441 -0.2213079844
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|
20 -0.1422159370 0.1338130754
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|
|
|
orbital 1 4 79 3.6006686157 1.0000000000
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1 0.0016336629 -0.0948360133
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2 -0.0040123125 0.2331672654
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3 -0.0001359310 0.0078469741
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4 0.0026812570 -0.1561440221
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5 0.0050388243 -0.2925930801
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6 0.0813179150 0.0488301245
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7 -0.1999223147 -0.1200577187
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8 0.0067319869 0.0040394166
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9 -0.1338756028 -0.0803999959
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10 -0.2508808458 -0.1506559741
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11 -0.0013424540 0.0781612477
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12 -0.0049885665 0.2896964534
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13 -0.0000568649 0.0034746206
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14 0.0018428884 -0.1074991900
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15 -0.0030133634 0.1755829326
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16 -0.0670126518 -0.0402489223
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17 -0.2483984337 -0.1491651865
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18 0.0029752764 0.0017886195
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19 -0.0921654014 -0.0553566511
|
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20 0.1505377493 0.0904127453
|
|
|
|
orbital 1 4 80 3.6173604999 1.0000000000
|
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1 0.1078160787 0.0116814684
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2 -0.0189764231 -0.0020607011
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3 -0.0267014569 -0.0028929186
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4 -0.0446466841 -0.0048333000
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5 0.3753525873 0.0406709531
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6 0.0640218318 -0.0875311476
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7 -0.0112624919 0.0154033785
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8 0.0158564717 -0.0216775967
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9 0.0265197398 -0.0362473650
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10 -0.2228817289 0.3047320557
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11 0.0951672058 0.0103077252
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12 -0.0838929107 -0.0090959888
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13 0.0717746800 0.0077781943
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14 -0.1361156325 -0.0147451179
|
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15 0.3573984417 0.0387158431
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16 0.0565157371 -0.0772602634
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|
17 -0.0498117718 0.0681095837
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|
18 -0.0426191584 0.0582684460
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19 0.0808314691 -0.1105042664
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20 -0.2122349340 0.2901558574
|
|
|
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orbital 1 4 81 3.6516541428 1.0000000000
|
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1 0.0459974310 0.0378958807
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2 0.0984029239 0.0810773622
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3 0.1116914017 0.0920212638
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4 0.2668867387 0.2198796015
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5 0.1837042899 0.1513434840
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6 0.0558183174 -0.0208864878
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7 0.1194146770 -0.0446833269
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8 -0.1355380734 0.0507163621
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9 -0.3238716184 0.1211827777
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10 -0.2229235610 0.0834100383
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11 -0.0086031884 -0.0070846510
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12 0.0978435348 0.0806170131
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13 -0.0968320265 -0.0797810560
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14 0.1771785067 0.1459750523
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|
15 -0.0195025580 -0.0160682590
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|
16 -0.0104372970 0.0039023833
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17 0.1187354670 -0.0444295001
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|
18 0.1175076543 -0.0439711098
|
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19 -0.2150080283 0.0804508283
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20 0.0236694181 -0.0088529119
|
|
|
|
orbital 1 4 82 3.7420347506 1.0000000000
|
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1 -0.0123445195 0.1124211287
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2 0.0180276747 -0.1641763095
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3 -0.0111703931 0.1017420991
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4 -0.0191606655 0.1745103608
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5 -0.0108894648 0.0991854687
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6 -0.0911876164 -0.0669015483
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7 0.1331680866 0.0976988292
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8 0.0825274754 0.0605478561
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9 0.1415499723 0.1038515674
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10 0.0804526296 0.0590264461
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11 -0.0046346562 0.0422068736
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12 -0.0410021004 0.3734468173
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13 -0.0057445516 0.0523426594
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14 0.0127080083 -0.1157472395
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15 0.0300653963 -0.2738301557
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|
16 -0.0342352561 -0.0251178587
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17 -0.3029115627 -0.2222354114
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18 0.0424556781 0.0311482836
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|
19 -0.0938865156 -0.0688794131
|
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20 -0.2221087960 -0.1629532318
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|
|
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orbital 1 4 83 3.7983186071 1.0000000000
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1 0.0789416329 0.0506591786
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2 -0.3342494887 -0.2144965860
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3 0.0486035012 0.0311894614
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4 0.1316765091 0.0844998887
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5 -0.0454557918 -0.0291705050
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6 0.0833422910 -0.0430356316
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7 -0.3528818527 0.1822156598
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8 -0.0513111697 0.0264971614
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|
9 -0.1390193228 0.0717849888
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10 0.0479880255 -0.0247781987
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11 0.0722085427 0.0463384279
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|
12 0.2849594857 0.1828658262
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13 0.0554572147 0.0355867591
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|
14 -0.1467259833 -0.0941560914
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|
15 -0.0328930102 -0.0211101954
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|
16 0.0762315741 -0.0393646880
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17 0.3008458686 -0.1553497539
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|
18 -0.0585508787 0.0302317085
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19 0.1549040900 -0.0799888454
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20 0.0347280180 -0.0179345165
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|
|
|
orbital 1 4 84 3.8105491166 1.0000000000
|
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1 0.0049090634 -0.0000866752
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2 -0.3817055755 0.0067732821
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3 0.0237815046 -0.0004227074
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4 0.0761424074 -0.0013521199
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5 -0.3294490736 0.0058444226
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6 -0.0023802801 0.0042943553
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7 0.1849937037 -0.3339543927
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8 0.0115270740 -0.0208085313
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|
9 0.0369003968 -0.0666159274
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10 -0.1596630958 0.2882300452
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11 0.0926969394 -0.0016434672
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12 -0.0180340712 0.0003192063
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|
13 0.0637608394 -0.0011337829
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|
14 -0.1011455317 0.0017960518
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|
15 0.1634369067 -0.0028986757
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|
16 -0.0449266787 0.0811005132
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|
17 0.0087356629 -0.0157726661
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|
18 0.0309018826 -0.0557854547
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|
19 -0.0490226948 0.0884970321
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20 0.0792074022 -0.1429904478
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|
|
|
orbital 1 4 85 4.4963554386 1.0015966173
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1 0.0987065431 -0.0316481917
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2 -0.0427048319 0.0136884376
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|
3 -0.3927294871 0.1259029235
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4 0.0029063191 -0.0009346613
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|
5 -0.0098395492 0.0031505622
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|
6 -0.0219586826 0.1013025698
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7 0.0094998768 -0.0438261682
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8 -0.0873359267 0.4030690282
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|
9 0.0006445771 -0.0029753020
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10 -0.0021891500 0.0100961814
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|
11 0.0526282699 -0.0168748477
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12 0.0646314324 -0.0207228874
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|
13 -0.3454969823 0.1107611307
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14 0.0241294091 -0.0077349431
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|
15 -0.0042163690 0.0013509459
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|
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17 -0.0143724082 0.0663328824
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|
18 -0.0768317364 0.3545893627
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19 0.0053665799 -0.0247641871
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|
20 -0.0009377586 0.0043275627
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|
|
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orbital 1 4 86 4.5269112277 1.0088706195
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1 -0.0899586017 0.3599914846
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2 -0.0147559867 0.0590359099
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3 0.0514490593 -0.2059221785
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4 -0.0094691377 0.0378760833
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5 0.0162025891 -0.0648479894
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6 0.2667784801 0.2579092683
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7 0.0437489222 0.0422925570
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8 0.1525959267 0.1475276868
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|
9 -0.0280704618 -0.0271355498
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10 0.0480576123 0.0464611610
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11 -0.0737701006 0.2952166293
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|
12 0.0078921194 -0.0315802289
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13 0.0420927485 -0.1684742041
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14 0.0054769788 -0.0219077654
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15 0.0102094244 -0.0408622013
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|
16 0.2187761873 0.2115050683
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|
17 -0.0234071642 -0.0226240801
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|
18 0.1248483693 0.1207068148
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|
19 0.0162315156 0.0156925109
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|
20 0.0302800108 0.0292761646
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|
|
|
orbital 1 4 87 4.5974839119 0.3422420772
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1 0.2461398322 -0.3387738251
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2 0.0399651236 -0.0550065688
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3 0.0092858313 -0.0127834698
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4 0.0089514771 -0.0123224563
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|
5 -0.0559856906 0.0770575683
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6 0.1703161368 0.3825513687
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7 0.0276551930 0.0621157621
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8 -0.0064256713 -0.0144330585
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|
9 -0.0061957748 -0.0139121159
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10 0.0387406799 0.0870167843
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11 -0.2028310656 0.2791645294
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|
12 0.0197989807 -0.0272488759
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13 0.0256433174 -0.0352919928
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14 0.0107045790 -0.0147353687
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15 0.0370614942 -0.0510094283
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|
16 -0.1403470705 -0.3152389438
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17 0.0136993068 0.0307677344
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|
18 -0.0177428969 -0.0398495359
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19 -0.0074090820 -0.0166380714
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20 -0.0256440240 -0.0576000599
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|
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orbital 1 4 88 4.7523579968 0.0000000000
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1 -0.0254412677 0.1809553564
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2 -0.0100345987 0.0713563754
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3 -0.0513113225 0.3648764113
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|
4 0.0093993489 -0.0668643598
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5 0.0079671205 -0.0566687886
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6 0.1439870432 0.1125176229
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7 0.0567807958 0.0443645503
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8 -0.2903384705 -0.2268718718
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|
9 0.0532051932 0.0415702751
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10 0.0450932471 0.0352396861
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11 -0.0194379891 0.1382571146
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12 0.0087888166 -0.0624936551
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13 -0.0418061827 0.2973176605
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|
14 -0.0044124109 0.0313918557
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15 0.0075773630 -0.0539037213
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|
16 0.1100129924 0.0859690686
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17 -0.0497301808 -0.0388592772
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18 -0.2365791645 -0.1848626121
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19 -0.0249811913 -0.0195238182
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20 0.0428897969 0.0335143887
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|
|
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orbital 1 4 89 5.6811342228 0.0000000000
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1 -0.0102854398 0.1490241121
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2 -0.0086912510 0.1258566181
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3 0.0145723601 -0.2109802700
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4 -0.0073173113 0.1059244467
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5 0.0086978644 -0.1260024134
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6 0.1239343770 0.0834365771
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7 0.1046477547 0.0704530496
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8 0.1754271263 0.1181096272
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|
9 -0.0880665732 -0.0592938379
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10 0.1047847447 0.0705496559
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11 0.0126884657 -0.1837514291
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12 -0.0095789620 0.1387224745
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13 -0.0182991945 0.2649249656
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14 -0.0085990338 0.1245220919
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15 -0.0098215397 0.1422387650
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16 -0.1527671656 -0.1028394046
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17 0.1153329104 0.0776452059
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18 -0.2202748891 -0.1483014764
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19 -0.1035414244 -0.0697146493
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20 -0.1182626254 -0.0796130018
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|
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orbital 1 4 90 5.7284244003 0.0000000000
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1 0.2419140863 0.0631972238
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2 0.1230378523 0.0321558209
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3 0.0404636761 0.0105819393
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|
4 -0.0429545907 -0.0112035439
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5 -0.1522898198 -0.0397903970
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6 -0.1756875114 0.1778847171
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7 -0.0893765877 0.0904941023
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8 0.0293995469 -0.0297472255
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|
9 -0.0312459747 0.0316164632
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10 -0.1106113574 0.1120037022
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11 0.3044921017 0.0795769349
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|
12 -0.1418895176 -0.0370869308
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|
13 0.0293900028 0.0076816101
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|
14 0.0311904548 0.0081450542
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15 -0.1853654461 -0.0484436334
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|
16 -0.2211355584 0.2239391570
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|
17 0.1030862764 -0.1043699238
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|
18 0.0212837036 -0.0215802553
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19 0.0226297952 -0.0229136997
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20 -0.1346317619 0.1363449369
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|
|
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orbital 1 4 91 5.8791014149 0.0000000000
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1 0.1283408556 0.1755105261
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2 0.0318452463 0.0435092922
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3 0.0961032852 0.1314222438
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|
4 -0.0766650976 -0.1048562046
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5 -0.0578835636 -0.0791757033
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6 0.2161797210 -0.0233765786
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7 0.0535921149 -0.0057694935
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8 -0.1618723442 0.0175285803
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|
9 0.1291298844 -0.0139804158
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10 0.0975123595 -0.0105348352
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|
11 -0.1559457764 -0.2132761437
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12 0.0412170477 0.0563346316
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13 -0.1252172773 -0.1713183817
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14 -0.0855262409 -0.1169653329
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15 0.0723208293 0.0989272540
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|
16 -0.2626536744 0.0284231160
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17 0.0694172333 -0.0075342253
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|
18 0.2109886506 -0.0228550309
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19 0.1440596259 -0.0155893847
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20 -0.1218238522 0.0131881700
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|
|
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orbital 1 4 92 6.2761983667 0.0000000000
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1 -0.0036647565 -0.0362761938
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2 0.0078383039 0.0773729826
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3 -0.0249073467 -0.2471893892
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4 0.0207314041 0.2048822243
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|
5 -0.0033546892 -0.0333215941
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6 0.0332985206 0.0149383470
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7 -0.0709226771 -0.0318855668
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|
8 -0.2265666340 -0.1019725101
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|
9 0.1877063350 0.0845220847
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10 -0.0304587183 -0.0137559655
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|
11 0.0043420358 0.0433390082
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|
12 0.0079673056 0.0791120792
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|
13 0.0295474000 0.2927980424
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|
14 0.0225093453 0.2230667217
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16 -0.0396804848 -0.0178978641
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|
17 -0.0725809822 -0.0326633677
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18 0.2683873379 0.1207657187
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19 0.2044384853 0.0920340785
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20 0.0224376343 0.0101030250
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|
|
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orbital 1 4 93 10.2475196025 0.0000000000
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1 0.0115507521 0.0020746630
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2 0.0190899172 -0.0079020240
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3 0.0039061554 0.0035890980
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4 0.0199023627 0.0081020923
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5 -0.0033063321 0.0124468950
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6 0.0087171997 0.0037324226
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7 0.0052566112 0.0218825146
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8 -0.0030367803 0.0008625392
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|
9 -0.0163668314 -0.0049428835
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10 -0.0011696376 0.0112967512
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11 0.0156968745 -0.0030973594
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12 -0.0211306620 0.0119456484
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13 -0.0009122214 0.0033699635
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14 -0.0116808411 -0.0030094136
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15 0.0022126069 0.0107337890
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17 -0.0053044745 -0.0282818687
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20 -0.0049937527 0.0046136261
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orbital 1 4 94 10.2647391708 0.0000000000
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1 -0.0059621289 -0.0101546240
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2 -0.0015049827 -0.0125860523
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3 -0.0056054589 -0.0060820440
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4 -0.0185041074 -0.0229941238
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6 -0.0096955322 0.0054214843
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7 -0.0063558517 0.0179676766
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8 0.0092496231 -0.0051669615
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9 0.0279482900 -0.0164317152
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10 0.0178271875 -0.0052139108
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11 -0.0016849221 -0.0101973498
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12 -0.0045586721 0.0122237162
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13 -0.0083750695 -0.0035173854
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14 0.0099555708 0.0116155616
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17 0.0022157498 -0.0165837137
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18 0.0072793498 -0.0025113774
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20 0.0207532884 -0.0089227776
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orbital 1 4 95 10.3468758474 0.0000000000
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1 -0.0177883123 -0.0036149793
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2 0.0242604114 -0.0021571007
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3 0.0159079376 -0.0006168503
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4 0.0020441212 -0.0047055235
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5 0.0236775184 -0.0009383941
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6 -0.0097036314 0.0146301752
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7 0.0123644092 -0.0110949022
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8 -0.0058134794 0.0085304117
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|
9 0.0015052083 -0.0039133197
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10 -0.0123882300 0.0163197364
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11 -0.0296939213 -0.0032944896
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12 -0.0126685643 0.0027136321
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13 0.0120087237 0.0007622949
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14 0.0016306363 0.0023479666
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15 0.0325318105 -0.0014047749
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18 -0.0087424542 0.0098735697
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19 -0.0008895520 0.0046451601
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20 -0.0164842693 0.0237077114
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orbital 1 4 96 10.4577264308 0.0000000000
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1 -0.0157403335 -0.0001649205
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2 -0.0142242985 -0.0002490145
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3 -0.0039186665 0.0017147318
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4 -0.0180889974 0.0017023482
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12 -0.0019603709 -0.0212725442
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17 -0.0029137629 -0.0316119951
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18 -0.0058097080 -0.0630214774
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19 0.0051999193 0.0563953467
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orbital 1 5 47 -0.4359856471 1.0000000000
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1 -0.0070044686 -0.0076649534
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3 0.0385759389 0.0422120171
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4 -0.0278803561 -0.0305084792
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5 -0.0184069956 -0.0201410813
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6 0.0540020157 0.0590933348
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11 0.0508507970 0.0556462860
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13 -0.0525852540 -0.0575422217
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18 0.0251815117 0.0275538581
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19 -0.0139528955 -0.0152681760
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20 0.0070428723 0.0077055868
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orbital 1 5 48 -0.3844176073 1.0000000000
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3 -0.0408180426 0.0446913216
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8 0.0229379560 -0.0251158585
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orbital 1 5 49 -0.2991265882 1.0000000000
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5 0.0492748628 0.0514174752
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orbital 1 5 50 -0.0656034473 1.0000000000
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orbital 1 5 51 0.1669747735 1.0000000000
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3 0.0120912344 -0.0149877718
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20 -0.1013213696 0.1255842411
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orbital 1 5 52 0.1869927852 1.0000000000
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orbital 1 5 53 0.3109098945 1.0000000000
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8 0.0758035753 -0.0360080329
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orbital 1 5 54 0.3773423038 1.0000000000
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4 0.0061386689 -0.0106346547
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20 -0.0422637374 0.0732204309
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orbital 1 5 55 0.5897453687 1.0000000000
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3 0.0369969696 -0.0156171234
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20 -0.0247516211 0.0104479114
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orbital 1 5 56 0.7800486682 1.0000000000
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3 -0.0168835636 -0.0106234254
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4 0.0560834270 0.0352872962
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20 0.1266546610 0.0796879614
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orbital 1 5 57 0.8836158237 1.0000000000
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3 0.0967337553 -0.0573127451
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20 -0.0083980831 0.0049770443
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1 -0.0244120723 -0.1362047373
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2 0.0166835665 0.0930908031
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3 -0.0393019009 -0.2193081165
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4 -0.0273129325 -0.1524060419
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5 0.0019011514 0.0106131655
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8 0.0270582108 0.1509777442
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9 0.0065013421 0.0362779877
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orbital 1 5 59 1.0257385515 1.0000000000
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1 -0.0610036412 -0.0924896205
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2 0.0377693068 0.0572628237
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3 -0.0012836866 -0.0019488454
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4 -0.0137337449 -0.0208217091
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5 0.0095747708 0.0145163893
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6 0.0792502445 0.1201536944
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7 0.0455051543 0.0689909275
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8 0.0482212009 0.0731083323
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20 -0.0115606626 -0.0175258028
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orbital 1 5 60 1.2018817288 1.0000000000
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2 0.2115965779 0.1603759711
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3 -0.0601920744 -0.0456246197
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4 -0.0667044339 -0.0505582323
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5 0.1453624620 0.1101751085
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7 -0.0529208352 -0.0401131248
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8 0.1342904913 0.1017822455
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3 -0.0988445612 -0.1503792805
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7 0.0162457624 -0.0225406094
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3 0.0066520145 0.0130997782
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4 0.0019244312 0.0037895225
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14 0.0016148526 0.0031754779
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15 -0.0459630260 -0.0905063823
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|
16 -0.0511027096 -0.1006351758
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17 -0.0099832795 -0.0196650404
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18 0.0333579679 0.0656955405
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|
19 -0.0410946063 -0.0809298126
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20 0.0114621140 0.0225699773
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|
|
|
orbital 1 5 64 1.7461825758 1.0000000000
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1 -0.0399676150 0.0160251082
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2 -0.0681074278 0.0273059270
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3 -0.0246398337 0.0098799756
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4 0.0294031232 -0.0117912535
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5 0.0395339605 -0.0158549335
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6 0.1098978126 -0.0440668597
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7 0.0742799706 -0.0297831431
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8 0.1715368429 -0.0687807834
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9 0.0674909863 -0.0270580172
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10 -0.0916687185 0.0367561608
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11 0.0305980105 -0.0122663269
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12 -0.0867307225 0.0347739286
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13 0.0296246912 -0.0118795045
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14 0.0421327542 -0.0168942686
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15 -0.0946257502 0.0379418771
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|
16 -0.0733806398 0.0294283335
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17 0.0653383215 -0.0261971898
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|
18 -0.1319093798 0.0528894956
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19 0.1212736108 -0.0486242623
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20 0.0398949254 -0.0159931127
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|
|
|
orbital 1 5 65 1.8296199122 1.0000000000
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1 -0.0458867298 -0.1811016940
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2 -0.0221932284 -0.0875916454
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3 -0.0019055009 -0.0075222067
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4 -0.0046590036 -0.0183880581
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5 0.0134275023 0.0529974226
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6 -0.0087708192 -0.0346174809
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7 -0.0157386436 -0.0621138338
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8 0.0138318996 0.0545932766
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9 0.0227545938 0.0898029248
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10 0.0223006313 0.0880140714
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11 -0.0208567327 -0.0823174403
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12 0.0234192463 0.0924333820
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13 -0.0004794926 -0.0018888263
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14 0.0027977942 0.0110440064
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15 0.0097832054 0.0386160634
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|
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17 0.0167843725 0.0662450500
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18 -0.0019922887 -0.0078652447
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19 -0.0113472919 -0.0447835123
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20 0.0264764208 0.1044963388
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|
|
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orbital 1 5 66 1.9615023918 1.0000000000
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1 0.0078040453 0.0135162514
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2 -0.0396053595 -0.0686103102
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3 -0.0516698936 -0.0895117654
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4 -0.0277225755 -0.0480272533
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5 0.0086350738 0.0149623444
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6 -0.0524024414 -0.0907785198
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7 0.0005145443 0.0008898346
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8 0.0312431410 0.0541289322
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9 -0.0002703674 -0.0004698586
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10 -0.0153241421 -0.0265486245
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11 -0.0342962233 -0.0594158215
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12 -0.0178604806 -0.0309378211
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13 0.0172386961 0.0298656808
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14 -0.0347129637 -0.0601328842
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15 0.0152448118 0.0264078951
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|
16 -0.0189658287 -0.0328606516
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17 0.0310191748 0.0537385708
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|
18 0.0186573202 0.0323211772
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19 0.0514386573 0.0891100743
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20 -0.0083173334 -0.0144080933
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|
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orbital 1 5 67 2.0002518058 1.0000000000
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1 -0.1103495690 0.0193246777
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2 0.1884181617 -0.0329999909
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3 0.1546264612 -0.0270814642
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4 0.1307428390 -0.0228983296
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5 -0.0104770305 0.0018355734
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6 0.0392644924 -0.0068792621
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7 -0.0863657219 0.0151243581
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8 -0.0141051491 0.0024718869
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9 -0.1636032028 0.0286546706
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10 0.0135686947 -0.0023752054
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11 0.1303330187 -0.0228283800
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12 0.2139153167 -0.0374643172
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13 -0.1995993755 0.0349562236
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14 0.1353193898 -0.0236995606
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15 0.0286252409 -0.0050118476
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17 -0.1438465512 0.0251933625
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18 0.0801650611 -0.0140376991
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19 -0.1181732046 0.0206958469
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20 -0.0328872229 0.0057584395
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|
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orbital 1 5 68 2.2342249505 1.0000000000
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1 0.0976990374 0.0686554870
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2 -0.0800133404 -0.0562267233
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3 -0.0768235923 -0.0539874635
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4 0.0361409726 0.0253968793
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5 0.0752575585 0.0528866093
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6 -0.0120186531 -0.0084448587
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7 0.1260732463 0.0885954245
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8 0.0596490988 0.0419157525
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9 -0.0223399089 -0.0156973775
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10 -0.0144393296 -0.0101452802
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13 -0.0367633114 -0.0258321876
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14 -0.0392721432 -0.0275981208
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|
18 -0.0046289006 -0.0032555118
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19 0.0858899696 0.0603541331
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20 0.0064789354 0.0045559509
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|
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orbital 1 5 69 2.3001806284 1.0000000000
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1 0.0081990349 0.0117711935
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2 0.0413156257 0.0593221354
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3 0.0374526119 0.0537739127
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|
4 -0.0450384199 -0.0646631148
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5 0.0111264701 0.0159747423
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6 0.0124579636 0.0178861775
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7 -0.0187682304 -0.0269468185
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8 0.0693027683 0.0994952663
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10 -0.0762729823 -0.1095061898
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11 0.0105339796 0.0151221776
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12 -0.0313785821 -0.0450487720
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13 0.0221693357 0.0318291005
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14 0.0623706058 0.0895471077
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|
15 -0.0039502897 -0.0056760119
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17 0.0079035584 0.0113476596
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18 0.0471356435 0.0676719412
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19 0.0632828325 0.0908539129
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20 -0.0878985036 -0.1261949673
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|
|
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orbital 1 5 70 2.3518397971 1.0000000000
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1 -0.0051437588 0.0747511717
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2 -0.0015825130 0.0229883015
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3 -0.0143992872 0.2092607381
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4 0.0061515813 -0.0893933032
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5 -0.0068265475 0.0992045965
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6 -0.0032097522 0.0466508418
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7 -0.0042797935 0.0622092042
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8 0.0019287059 -0.0280416795
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10 -0.0054473128 0.0791555994
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12 0.0009145783 -0.0132931605
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13 -0.0084472427 0.1227615387
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14 -0.0091905832 0.1335426652
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15 -0.0061993024 0.0900906114
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17 0.0083559250 -0.1214250526
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18 0.0039175384 -0.0569442257
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20 -0.0061992498 0.0901077754
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|
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orbital 1 5 71 2.5097615414 1.0000000000
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1 0.0264379826 0.0442124205
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2 -0.0314367324 -0.0525660901
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3 0.0014595696 0.0024423297
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4 0.0137994496 0.0230754805
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5 -0.0330376840 -0.0552470856
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6 0.0771363180 0.1289865371
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7 -0.0111889150 -0.0187112810
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8 0.0016025598 0.0026811173
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10 -0.0403358988 -0.0674499005
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12 -0.0209739328 -0.0350745059
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13 -0.0253670292 -0.0424190251
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14 0.0376903711 0.0630266921
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15 -0.0469653227 -0.0785372028
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17 -0.0776626503 -0.1298680603
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|
18 -0.0392344396 -0.0656077173
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19 0.0091102305 0.0152367499
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20 -0.0492421173 -0.0823494976
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orbital 1 5 72 2.5756095290 1.0000000000
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1 0.1177423574 -0.0290324706
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2 -0.1965861587 0.0484740941
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3 0.1745209632 -0.0430325954
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4 0.2857933280 -0.0704699329
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5 -0.0556731332 0.0137278303
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6 0.0948352892 -0.0233837340
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7 -0.3499431989 0.0862880804
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8 0.2360668844 -0.0582085528
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9 0.1451972508 -0.0358018311
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10 0.0684611492 -0.0168804441
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12 -0.2012573431 0.0496260088
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13 -0.1717890116 0.0423588030
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14 0.3354335540 -0.0827098845
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17 -0.3243447981 0.0799760735
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19 0.1949257564 -0.0480639786
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20 0.0009752551 -0.0002400501
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orbital 1 5 73 2.6589770402 1.0000000000
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1 -0.0007821190 0.0045465007
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2 0.0128750789 -0.0747276485
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3 0.0087227243 -0.0506245519
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4 0.0065280934 -0.0378818313
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5 -0.0127188899 0.0738138128
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6 0.0009932292 -0.0057522243
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7 0.0271506666 -0.1575785967
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9 0.0129870299 -0.0753580798
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11 0.0040615968 -0.0235694987
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12 0.0173684084 -0.1007856567
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13 -0.0082638255 0.0479624670
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14 0.0141346352 -0.0820216322
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15 0.0102944367 -0.0597477264
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17 0.0224666222 -0.1303862941
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18 0.0031323847 -0.0181932766
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19 0.0127910209 -0.0742302161
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20 0.0040523808 -0.0235166844
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orbital 1 5 74 2.9991201848 1.0000000000
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1 0.0105521658 0.1013443621
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2 -0.0052174664 -0.0501183509
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3 0.0103504124 0.0994106497
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4 -0.0462070003 -0.4437821727
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5 -0.0197373658 -0.1895523145
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6 0.0028617306 0.0274739732
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7 0.0207592364 0.1993810678
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8 0.0139277079 0.1337633999
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9 -0.0327348658 -0.3143784882
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10 0.0290358796 0.2788611546
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11 0.0077209460 0.0741504164
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12 0.0108713161 0.1044056046
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13 0.0107238384 0.1030018725
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14 0.0320623372 0.3079259367
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15 -0.0217468593 -0.2088515039
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16 0.0022918905 0.0220179608
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17 -0.0173782973 -0.1668992174
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18 0.0139889931 0.1343489763
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19 0.0271907790 0.2611588857
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20 0.0327338185 0.3143815645
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|
|
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orbital 1 5 75 3.1886335001 1.0000000000
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1 0.0168107203 0.0656556464
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2 -0.0265101609 -0.1035527930
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3 -0.0313598932 -0.1224880381
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4 0.0180511668 0.0705014148
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5 -0.0303761336 -0.1186526669
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6 -0.0245478941 -0.0958830191
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7 0.0513144884 0.2004188864
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8 0.0304232614 0.1188263022
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9 0.0059073832 0.0230720205
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10 -0.0041017626 -0.0160111347
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11 -0.0211269091 -0.0825143521
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|
12 -0.0829652806 -0.3240526615
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13 0.0377920135 0.1476000021
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14 -0.0778383562 -0.3040207116
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15 -0.0053167467 -0.0207686159
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16 0.0041649494 0.0162749088
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17 0.0132828450 0.0518778160
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18 -0.0243889145 -0.0952539533
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19 0.1061300620 0.4145194155
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20 0.0095799320 0.0374157446
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|
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orbital 1 5 76 3.2411641180 1.0000000000
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1 0.0025384637 -0.0024922183
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2 -0.2518065071 0.2471472789
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3 -0.0706578277 0.0693504899
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4 -0.1681479753 0.1650386027
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5 0.1031106367 -0.1012038250
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6 0.0183612408 -0.0180229302
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7 0.0705572083 -0.0692508019
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8 0.0052698310 -0.0051723872
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9 0.2393863061 -0.2349581105
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10 0.1538688144 -0.1510205135
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11 -0.0121735983 0.0119488223
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12 -0.0690985451 0.0678194360
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13 0.0517629661 -0.0508076193
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14 0.2630804013 -0.2582153234
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15 0.0008428714 -0.0008271520
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16 0.0919961017 -0.0902933573
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17 0.2259448986 -0.2217680508
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18 -0.0315025984 0.0309211484
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19 -0.1204597316 0.1182318591
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20 -0.1625558996 0.1595500988
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orbital 1 5 77 3.2908632061 1.0000000000
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1 -0.0089166527 -0.0700346199
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2 0.0044029798 0.0345894718
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3 0.0000881773 0.0006735796
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4 0.0527960695 0.4147101835
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5 0.0115324640 0.0905932924
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6 -0.0065466333 -0.0514086172
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7 0.0292140989 0.2294690965
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8 -0.0052518919 -0.0412473126
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9 -0.0455949907 -0.3581627696
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10 0.0495105312 0.3889102051
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11 0.0024892119 0.0195499508
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12 -0.0200128291 -0.1572031969
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13 -0.0004101425 -0.0032212447
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14 0.0107217252 0.0842292727
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15 -0.0359089870 -0.2820937348
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17 0.0096531968 0.0758240667
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18 0.0117841336 0.0925667035
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19 -0.0014963285 -0.0117757945
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20 -0.0422187386 -0.3316431045
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orbital 1 5 78 3.4624785499 1.0000000000
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1 -0.0626258736 -0.0935639028
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2 0.0672504784 0.1004748179
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3 0.0424216370 0.0633803948
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4 0.0158484272 0.0236785466
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5 -0.2155126128 -0.3219858964
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6 -0.0478728101 -0.0715266062
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7 0.0325482438 0.0486272614
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8 -0.0229432249 -0.0342827444
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9 0.0398973625 0.0596078362
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10 0.1068437574 0.1596292912
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11 0.0988002757 0.1476120810
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12 0.0883499611 0.1320005840
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13 -0.0419981247 -0.0627437354
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14 0.0284328742 0.0424799153
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15 0.2540841789 0.3796200086
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16 0.0638070290 0.0953294650
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17 0.0272619992 0.0407310666
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18 0.0040294096 0.0060185780
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20 -0.1284977986 -0.1919815507
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orbital 1 5 79 3.5738184552 1.0000000000
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1 0.0946903322 0.1630836056
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2 -0.1210858441 -0.2085512853
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3 0.0401196007 0.0691041545
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4 0.0499841703 0.0860908462
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5 0.2198179451 0.3785949953
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6 -0.0629777638 -0.1084728615
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7 0.0689376266 0.1187350939
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8 -0.0274001507 -0.0471914835
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9 -0.0557457791 -0.0960070041
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10 0.0905888254 0.1560285206
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11 0.0904712798 0.1558243910
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12 0.0654802038 0.1127759274
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13 0.0491473773 0.0846441742
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14 -0.0338354782 -0.0582763868
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15 0.1675744761 0.2886209208
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17 -0.0453627965 -0.0781291669
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18 -0.0227896993 -0.0392519966
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19 0.0199168858 0.0343040082
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20 0.0685015890 0.1179835258
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orbital 1 5 80 3.6614700683 1.0000000000
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1 -0.0997091826 -0.0016945525
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2 0.1777847189 0.0030249037
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3 0.0693267725 0.0011816775
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4 0.1197398077 0.0020351587
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5 -0.2085953948 -0.0035463527
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6 -0.1577461641 -0.0026838072
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7 0.1659534471 0.0028224656
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8 0.1047270550 0.0017789933
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9 0.3406437066 0.0057946896
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10 0.3337531879 0.0056792875
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11 -0.0496041064 -0.0008452874
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12 -0.1587783512 -0.0027023494
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13 0.0509756642 0.0008708298
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14 -0.0961964347 -0.0016380031
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15 -0.0529748662 -0.0008997979
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16 -0.1350444682 -0.0022982659
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17 -0.1301887074 -0.0022138458
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18 0.1069613333 0.0018162129
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19 -0.2837567597 -0.0048283931
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orbital 1 5 81 3.7676174790 1.0000000000
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1 0.0043060451 -0.0390620169
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orbital 1 5 82 3.8215500044 1.0000000000
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3 -0.0168338512 0.0056771141
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3 0.2339370466 -0.2319914793
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4 0.0432670898 -0.0429097770
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1 0.0112618588 -0.0004038749
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3 0.0236611776 0.0009792830
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20 -0.0004521324 -0.0001120266
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orbital 1 6 14 -20.9218537117 1.0000000000
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3 -0.0010642241 -0.0016245723
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orbital 1 6 15 -20.9021866384 1.0000000000
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orbital 1 6 16 -20.8673533750 1.0000000000
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orbital 1 6 17 -20.8513250571 1.0000000000
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orbital 1 6 18 -20.8203786166 1.0000000000
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orbital 1 6 19 -20.6888371832 1.0000000000
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orbital 1 6 20 -20.6632072433 1.0000000000
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orbital 1 6 21 -20.6405029064 1.0000000000
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orbital 1 6 22 -20.6230059883 1.0000000000
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7 0.0013616613 -0.0003800128
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19 0.0082110654 -0.0022896521
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20 0.0019532002 -0.0005456746
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orbital 1 6 32 -12.9149506505 1.0000000000
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1 0.0178490607 0.0438014664
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4 -0.0056600443 -0.0138900374
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20 0.0019914259 -0.0025652879
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orbital 1 6 33 -12.8942342297 1.0000000000
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20 -0.0111396279 -0.0082006702
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orbital 1 6 34 -12.8655179644 1.0000000000
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orbital 1 6 35 -12.8245552290 1.0000000000
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1 0.0242992290 0.0073231133
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18 0.0000970203 0.0004153464
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20 -0.0029278838 -0.0124553639
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orbital 1 6 36 -12.7800118503 1.0000000000
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orbital 1 6 39 -1.5675319945 1.0000000000
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orbital 1 6 40 -1.5019808926 1.0000000000
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4 0.0023504775 -0.0101885537
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20 0.1035490839 -0.0316826947
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3 -0.0882542718 -0.0508764239
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4 0.0292201203 0.0168445717
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20 0.0000173429 0.0268900493
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orbital 1 6 44 -0.7976699215 1.0000000000
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1 0.0481569266 -0.0000571727
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3 0.2346515744 -0.0002721445
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9 -0.0008737100 0.0437807149
|
|
10 0.0011570202 -0.0579175213
|
|
11 0.0391379311 0.0236497958
|
|
12 -0.0413426377 -0.0249819447
|
|
13 0.0083303987 0.0050337751
|
|
14 0.0404178625 0.0244234741
|
|
15 -0.0131496880 -0.0079458520
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|
16 -0.0050553318 0.2532680029
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|
17 0.0011192819 -0.0560719630
|
|
18 -0.0032776883 0.1641955480
|
|
19 -0.0009394871 0.0470484759
|
|
20 -0.0019453092 0.0973811000
|
|
|
|
orbital 1 6 49 -0.2991265306 1.0000000000
|
|
1 -0.0198276449 0.0391144350
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|
2 -0.0225920427 0.0445683910
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|
3 -0.0321789967 0.0634803906
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|
4 0.0234053120 -0.0461712796
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|
5 0.0308550662 -0.0608652983
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6 -0.2059028057 0.0112146015
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|
7 -0.0646727053 0.0035229856
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8 -0.1264524040 0.0068875777
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|
9 0.0313873688 -0.0017093745
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|
10 -0.0711101486 0.0038724205
|
|
11 0.0086770853 -0.0171126472
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|
12 0.0494776640 -0.0976011608
|
|
13 0.0096592415 -0.0190545137
|
|
14 -0.0127750061 0.0251993266
|
|
15 0.0289901443 -0.0571905008
|
|
16 -0.1087593621 0.0059244976
|
|
17 0.0206390146 -0.0011244154
|
|
18 0.0365270368 -0.0019911875
|
|
19 0.0560631233 -0.0030543250
|
|
20 0.0912646282 -0.0049703107
|
|
|
|
orbital 1 6 50 -0.0656034001 1.0000000000
|
|
1 0.0010749254 -0.0100934621
|
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2 -0.0065569410 0.0615627314
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3 0.0034554308 -0.0324439909
|
|
4 0.0054592514 -0.0512580861
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|
5 -0.0004983857 0.0046834510
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6 -0.0630251507 0.0279548840
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7 0.0813547568 -0.0360863583
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8 -0.1167559965 0.0517889972
|
|
9 -0.0206366805 0.0091533878
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|
10 -0.0477659114 0.0211874425
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11 0.0020711239 -0.0194517426
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|
12 0.0151797051 -0.1425149957
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|
13 0.0130890117 -0.1228910096
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14 -0.0075671999 0.0710471695
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|
15 -0.0135848319 0.1275557014
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|
16 -0.1227383592 0.0544424234
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|
17 -0.1092249871 0.0484477805
|
|
18 -0.1349989482 0.0598807993
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|
19 0.0424035964 -0.0188081975
|
|
20 -0.0424688848 0.0188371373
|
|
|
|
orbital 1 6 51 0.1669747762 1.0000000000
|
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1 0.1819830943 -0.0580698212
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2 0.0940444180 -0.0300099190
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3 0.0062940332 -0.0020067794
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|
4 -0.0291780256 0.0093104769
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|
5 0.0766233066 -0.0244533834
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6 0.0500495681 0.0455324324
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|
7 -0.0004255057 -0.0003915709
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8 -0.0142406956 -0.0129620343
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|
9 0.0004610475 0.0004212255
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|
10 -0.0357393442 -0.0325191945
|
|
11 -0.3062378064 0.0977215137
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|
12 0.0601385172 -0.0191897258
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|
13 -0.0188677016 0.0060187067
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|
14 0.0120890394 -0.0038589061
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|
15 -0.1537224741 0.0490571282
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|
16 -0.0447367604 -0.0406946314
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|
17 0.0604322481 0.0549853872
|
|
18 0.0581054443 0.0528750110
|
|
19 -0.0182977754 -0.0166493393
|
|
20 0.1140569933 0.1037857282
|
|
|
|
orbital 1 6 52 0.1869929629 1.0000000000
|
|
1 0.1148737537 -0.0549400941
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2 0.0166299499 -0.0079506701
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3 0.0685315577 -0.0327809695
|
|
4 -0.0205724690 0.0098390111
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|
5 -0.0714626829 0.0341858232
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6 -0.1833144799 -0.1256883448
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|
7 -0.0671743820 -0.0460573887
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8 -0.0386612870 -0.0265111469
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|
9 0.0225832372 0.0154845827
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|
10 0.0251693591 0.0172536424
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|
11 -0.0809299478 0.0386982948
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|
12 0.0663240374 -0.0317228557
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|
13 -0.0616925162 0.0295099953
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|
14 -0.0449942753 0.0215235879
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|
15 0.0873365702 -0.0417828621
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|
16 0.2049793894 0.1405398556
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|
17 -0.0965281444 -0.0661817802
|
|
18 -0.0149930265 -0.0102754330
|
|
19 0.0409424049 0.0280716814
|
|
20 -0.0422237748 -0.0289430533
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|
|
|
orbital 1 6 53 0.3109098325 1.0000000000
|
|
1 0.0523459350 -0.0018749766
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2 -0.0694120251 0.0024836578
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3 -0.0838669385 0.0030014875
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|
4 -0.0059803208 0.0002140244
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|
5 -0.0506156722 0.0018114040
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6 0.0473208913 0.0755840872
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7 -0.0251871821 -0.0402306249
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8 -0.0278391051 -0.0444653416
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|
9 -0.0197406914 -0.0315310420
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|
10 0.0196195518 0.0313380053
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11 0.1194490241 -0.0042738776
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|
12 0.2055253787 -0.0073561764
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13 -0.2169054553 0.0077630839
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|
14 0.0367441713 -0.0013147518
|
|
15 -0.1414090567 0.0050600511
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|
16 0.0746009101 0.1191565153
|
|
17 0.0871988187 0.1392801449
|
|
18 -0.1124834188 -0.1796645463
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|
19 0.0792563749 0.1265923966
|
|
20 0.0404642816 0.0646300198
|
|
|
|
orbital 1 6 54 0.3773421346 1.0000000000
|
|
1 0.0564526207 -0.0122249761
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2 -0.0171964698 0.0037226834
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3 0.0580862438 -0.0125778061
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|
4 -0.0444007647 0.0096152955
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|
5 -0.0877066154 0.0189894648
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6 0.0169552125 0.0186838510
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7 0.0037623416 0.0041457084
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|
8 -0.0166076856 -0.0183036621
|
|
9 0.0082509055 0.0090938829
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|
10 -0.0981971274 -0.1082296408
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|
11 -0.0435596425 0.0094357356
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|
12 0.0048804766 -0.0010584108
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|
13 -0.0293211553 0.0063510693
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|
14 -0.0664198127 0.0143829885
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|
15 0.0826279311 -0.0178888270
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|
16 -0.0606190367 -0.0668092802
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|
17 -0.0287955243 -0.0317395167
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|
18 0.0063902579 0.0070432534
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|
19 0.0118320260 0.0130404674
|
|
20 0.1105937577 0.1218888643
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|
|
|
orbital 1 6 55 0.5897451934 1.0000000000
|
|
1 -0.0291576384 -0.0182695882
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2 -0.0296565508 -0.0185812504
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3 0.0552899033 0.0346416358
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|
4 0.0392035957 0.0245633652
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|
5 -0.0154757543 -0.0096963038
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6 -0.0034816426 0.0963151086
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|
7 -0.0011569072 0.0319825191
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|
8 -0.0014495453 0.0401332761
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|
9 0.0007568334 -0.0209448190
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|
10 -0.0028874680 0.0798906721
|
|
11 -0.0146907093 -0.0092045848
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|
12 -0.0477421498 -0.0299131368
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|
13 0.1159802918 0.0726690578
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|
14 -0.0776455862 -0.0486501960
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|
15 0.0227661880 0.0142649523
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|
16 0.0000122522 -0.0003646853
|
|
17 0.0032456488 -0.0898049693
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|
18 -0.0023387976 0.0647301660
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|
19 0.0012950134 -0.0358479588
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|
20 -0.0017383977 0.0480896693
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|
|
|
orbital 1 6 56 0.7800487763 1.0000000000
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|
1 0.1871103829 -0.0799034541
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2 0.0104038065 -0.0044409775
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3 -0.0943913226 0.0403089315
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|
4 0.0208987337 -0.0089255238
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|
5 0.0760656986 -0.0324833601
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|
6 0.0909024222 0.0681896135
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|
7 0.0356684776 0.0267563174
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|
8 0.0159578254 0.0119694014
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|
9 -0.0530045405 -0.0397621437
|
|
10 -0.0140179134 -0.0105155522
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|
11 0.1186902151 -0.0506832061
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|
12 -0.0530305024 0.0226439489
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|
13 -0.0684019164 0.0292099998
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|
14 -0.0003758567 0.0001608689
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|
15 0.1376168068 -0.0587679680
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|
16 0.0200179476 0.0150148647
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|
17 -0.0131604721 -0.0098730232
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|
18 0.0777753125 0.0583435229
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|
19 -0.0143208082 -0.0107436288
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|
20 0.0362401620 0.0271846800
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|
|
|
orbital 1 6 57 0.8836159607 1.0000000000
|
|
1 -0.1428931667 -0.0583427706
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|
2 0.0123386480 0.0050378865
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3 -0.0325757429 -0.0133018276
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|
4 0.0308759667 0.0126067801
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|
5 0.0849597138 0.0346903330
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|
6 0.0082372440 0.0602114819
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|
7 0.0092602354 0.0676940268
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|
8 0.0152403851 0.1114000071
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|
9 -0.0005272009 -0.0038520876
|
|
10 0.0057019661 0.0416832007
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|
11 -0.0504780214 -0.0206092535
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|
12 0.0427599404 0.0174590650
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|
13 -0.0631640286 -0.0257928490
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|
14 0.0142622548 0.0058230773
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|
15 0.0090384492 0.0036920573
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|
16 0.0077414383 0.0565964312
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|
17 0.0005809313 0.0042477111
|
|
18 0.0021615122 0.0158040744
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|
19 0.0075021131 0.0548393832
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|
20 0.0043057348 0.0314793357
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|
|
|
orbital 1 6 58 0.9562857539 1.0000000000
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1 -0.0087361953 -0.0078459101
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2 -0.1752999324 -0.1574108466
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|
3 -0.1141255475 -0.1024801056
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|
4 -0.0274226182 -0.0246258512
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|
5 -0.1478871725 -0.1327948975
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6 -0.0285872458 0.1353897998
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|
7 0.0195382630 -0.0925319859
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8 0.0460272864 -0.2179958549
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|
9 0.0319868072 -0.1514927371
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|
10 -0.0022282242 0.0105500186
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|
11 -0.0348511487 -0.0312929612
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|
12 -0.0817915138 -0.0734444670
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|
13 0.0394784589 0.0354484933
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|
14 0.0018090152 0.0016232409
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|
15 0.0658969890 0.0591725699
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|
16 0.0207304880 -0.0981884400
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|
17 -0.0016161229 0.0076585976
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|
18 -0.0163929729 0.0776433409
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|
19 0.0164504029 -0.0779075755
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|
20 -0.0050829670 0.0240755172
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|
|
|
orbital 1 6 59 1.0257388446 1.0000000000
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1 -0.0060346119 0.1438092516
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2 -0.0034639015 0.0825739132
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3 0.0036724358 -0.0875035062
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|
4 0.0033197468 -0.0791313954
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|
5 -0.0058689314 0.1398548184
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6 -0.0981906926 0.0513265968
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|
7 0.0607927639 -0.0317781014
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|
8 0.0020676616 -0.0010804307
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|
9 0.0221060522 -0.0115549919
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|
10 -0.0154114580 0.0080551467
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|
11 -0.0055769841 0.1329416610
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|
12 -0.0017190760 0.0409791364
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|
13 -0.0064944217 0.1547707768
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|
14 0.0058201888 -0.1387100025
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|
15 -0.0008809761 0.0209763433
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|
16 -0.0109480688 0.0057227152
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|
17 0.2472546947 -0.1292461926
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|
18 0.0891313919 -0.0465930514
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|
19 0.0169438280 -0.0088570770
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|
20 0.0999140010 -0.0522283739
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|
|
|
orbital 1 6 60 1.2018819517 1.0000000000
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1 0.0293419259 0.0108872835
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2 -0.0622580608 -0.0231004595
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3 -0.1579796289 -0.0586145943
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|
4 -0.0419221999 -0.0155535049
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|
5 0.0266591379 0.0098926540
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6 -0.0122968493 -0.0723500726
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|
7 -0.0444802343 -0.2617511673
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|
8 -0.0126544601 -0.0744597368
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|
9 -0.0140205488 -0.0825157262
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|
10 0.0305564053 0.1798181339
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|
11 -0.1303632819 -0.0483691161
|
|
12 -0.0167621902 -0.0062180426
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|
13 0.0033581423 0.0012470804
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|
14 0.0183292862 0.0068007411
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|
15 -0.1202439192 -0.0446140328
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|
16 0.0065067892 0.0382848321
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|
17 -0.0112434852 -0.0661651404
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|
18 0.0146433607 0.0861745252
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|
19 -0.0113900230 -0.0670259086
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|
20 -0.0158162229 -0.0930716195
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|
|
|
orbital 1 6 61 1.2813897342 1.0000000000
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1 -0.0533092354 -0.2057431454
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2 0.0297840106 0.1149451493
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|
3 -0.0386583315 -0.1491972008
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|
4 -0.0476710905 -0.1839877688
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|
5 -0.0185229240 -0.0715032438
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|
6 -0.0050902652 0.0050056786
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|
7 0.1359766739 -0.1337470140
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8 -0.1282975472 0.1261935573
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|
9 -0.0395139563 0.0388666375
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|
10 -0.0646273011 0.0635684652
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|
11 0.0083593491 0.0322728257
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|
12 0.0278451830 0.1074608944
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|
13 0.0156552690 0.0604193616
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|
14 -0.0320478195 -0.1236866398
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|
15 -0.0075913078 -0.0293012500
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|
16 0.1001490268 -0.0985038177
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|
17 0.0075194175 -0.0073968178
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|
18 0.0624981362 -0.0614718827
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|
19 -0.0226555399 0.0222845313
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|
20 -0.0551422730 0.0542358577
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|
|
|
orbital 1 6 62 1.3566431607 1.0000000000
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|
1 -0.0126922313 -0.0261704878
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2 0.0121271101 0.0250002488
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3 -0.0247487343 -0.0510258331
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|
4 -0.0160539189 -0.0330969339
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|
5 0.0206931373 0.0426647311
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|
6 -0.1137855975 0.1678895554
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|
7 0.0111250972 -0.0164183602
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|
8 -0.0174112186 0.0256893318
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|
9 0.0083597960 -0.0123347906
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|
10 0.1266934852 -0.1869338312
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|
11 -0.0055058569 -0.0113517771
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|
12 0.0047967366 0.0098896205
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|
13 -0.0046533407 -0.0095915638
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|
14 -0.0110170615 -0.0227134774
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|
15 0.0235319419 0.0485229277
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|
16 -0.0820562696 0.1210766938
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|
17 -0.0055447584 0.0081799658
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|
18 0.0099936315 -0.0147448426
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|
19 -0.0134142080 0.0197928677
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|
20 0.1118997910 -0.1651091684
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|
|
|
orbital 1 6 63 1.6115986696 1.0000000000
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1 0.0226740354 -0.1243130621
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2 -0.0087490168 0.0479844498
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3 0.0173000877 -0.0948671501
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|
4 0.0128893429 -0.0706805528
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|
5 -0.0037243143 0.0204289257
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|
6 -0.0304406645 0.0108791046
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|
7 -0.0217872818 0.0077856719
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8 0.0138339264 -0.0049411411
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|
9 0.0040021236 -0.0014296602
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|
10 0.1277350369 -0.0456444875
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|
11 -0.0202495140 0.1110320881
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|
12 -0.0039567037 0.0216980927
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|
13 -0.0132170318 0.0724852024
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|
14 0.0162831454 -0.0892927592
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|
15 -0.0045435915 0.0249033626
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|
16 0.0423341395 -0.0151297146
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|
17 -0.0421793416 0.0150735554
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|
18 -0.0323523509 0.0115587699
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19 0.0033539073 -0.0011986839
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|
20 -0.0955906607 0.0341562450
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|
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orbital 1 6 64 1.7461825826 1.0000000000
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1 -0.1129804064 -0.0354212485
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2 -0.0763633137 -0.0239389498
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3 0.1763546830 0.0552786094
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|
4 0.0693839401 0.0217482907
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5 -0.0942372903 -0.0295399540
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6 -0.0093916953 -0.0420217511
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|
7 -0.0160034162 -0.0716128560
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8 0.0057897181 0.0259139358
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|
9 -0.0069069491 -0.0309161181
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|
10 -0.0092853140 -0.0415709967
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|
11 0.0754395241 0.0236495220
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|
12 -0.0671723009 -0.0210538270
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|
13 -0.1356087528 -0.0425080318
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|
14 0.1246754418 0.0390782723
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|
15 0.0410085963 0.0128573545
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|
16 0.0071892602 0.0321728479
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|
17 -0.0203782253 -0.0911917025
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|
18 -0.0069620748 -0.0311508570
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|
19 -0.0098998171 -0.0443013286
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|
20 0.0222297501 0.0994978698
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|
|
|
orbital 1 6 65 1.8296197563 1.0000000000
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|
1 0.0063989774 0.0351325794
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2 0.0114804583 0.0630366115
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3 0.0100908991 0.0554052119
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|
4 0.0165987668 0.0911425775
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|
5 0.0162675560 0.0893267397
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|
6 0.1424388376 -0.1208885991
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|
7 0.0688917036 -0.0584696443
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|
8 -0.0059147702 0.0050228774
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|
9 -0.0144634015 0.0122746894
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10 0.0416822383 -0.0353777505
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11 0.0094262908 0.0517544547
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|
12 -0.0122440634 -0.0672317653
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13 -0.0014526264 -0.0079825223
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20 0.0303707800 -0.0257787848
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orbital 1 6 66 1.9615023064 1.0000000000
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1 -0.0705426849 0.0775301258
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2 0.0006918845 -0.0007607103
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3 -0.0420595144 0.0462300023
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4 0.0003661063 -0.0003989575
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5 0.0206298418 -0.0226750447
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7 0.0774047933 0.0168730726
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8 -0.1009833775 -0.0220149816
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15 0.0111972605 -0.0123059329
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17 0.0349020234 0.0076070977
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18 0.0336969070 0.0073421673
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19 -0.0678397814 -0.0147893212
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20 0.0297964954 0.0064963683
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orbital 1 6 67 2.0002517280 1.0000000000
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1 0.0243285019 0.0315801544
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2 -0.0535105511 -0.0694614829
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3 0.0087397839 0.0113427314
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5 -0.0084075133 -0.0109109326
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20 -0.0110685664 0.0268664888
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orbital 1 6 68 2.2342249781 1.0000000000
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4 0.0231693231 -0.0144412865
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9 0.0389793869 0.0207800547
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20 0.0622152950 0.0331663158
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orbital 1 6 69 2.3001807657 1.0000000000
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1 0.0022428368 0.0216835911
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3 -0.0124774955 -0.1206082229
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4 0.0137755987 0.1331558461
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orbital 1 6 70 2.3518401165 1.0000000000
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1 -0.0081771115 -0.0460433804
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4 0.0239648285 0.1349266273
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orbital 1 6 71 2.5097615505 1.0000000000
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1 -0.0781053611 0.1284045035
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3 0.0016226478 -0.0026681662
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orbital 1 6 72 2.5756095648 1.0000000000
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20 -0.1945746723 0.0789471229
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1 0.0289600366 -0.0946401737
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3 0.0358908330 -0.1172919109
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orbital 1 6 76 3.2411640592 1.0000000000
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3 -0.0073461450 0.0007530375
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18 0.0424819662 0.0587889209
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20 0.0006877784 0.0009570184
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orbital 1 6 77 3.2908629537 1.0000000000
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1 -0.0215999731 -0.0471053756
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2 0.0964194333 0.2102722526
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3 0.0173299800 0.0377972408
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4 0.1504894686 0.3281961057
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5 -0.1634092062 -0.3563694167
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20 0.1645970631 -0.2318933156
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orbital 1 6 78 3.4624788652 1.0000000000
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1 -0.0306946560 0.0804088062
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3 0.0147133594 -0.0385435326
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4 -0.0255823699 0.0670121349
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20 0.4510479864 -0.0722923913
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orbital 1 6 79 3.5738184091 1.0000000000
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1 0.0482345641 -0.1157807606
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2 -0.0527999907 0.1267352885
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3 -0.0209853901 0.0503705228
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4 -0.0426950872 0.1024795657
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5 0.0693830130 -0.1665459258
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6 0.1870157865 -0.0242312985
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20 -0.3309707067 0.0428848965
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3 0.0455923261 -0.0942974863
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4 0.1482981591 -0.3067268731
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5 0.1452959625 -0.3005189642
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8 0.1223990427 -0.0235889865
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20 -0.1122251676 0.0216269604
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4 -0.2700533427 -0.0423778452
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9 -0.0227137036 -0.0118695015
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20 -0.0054417104 -0.0028423441
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orbital 1 7 35 -12.7783779096 1.0000000000
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orbital 1 7 36 -12.7446551902 1.0000000000
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orbital 1 7 37 -1.9370371747 1.0000000000
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orbital 1 7 38 -1.6979996070 1.0000000000
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orbital 1 7 39 -1.6326549140 1.0000000000
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orbital 1 7 40 -1.1871158156 1.0000000000
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orbital 1 7 68 2.1323685901 1.0000000000
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1 -0.1433243141 -0.0265123355
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orbital 1 8 35 -12.8245552232 1.0000000000
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4 0.0055262190 -0.0036743327
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7 0.0008856692 0.0139981118
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orbital 1 8 52 0.1869929071 1.0000000000
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1 0.1226238494 0.0343194364
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2 0.0177516754 0.0049660931
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3 0.0731549931 0.0204779669
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4 -0.0219607420 -0.0061469652
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14 -0.0480304595 -0.0134455803
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15 0.0932306576 0.0261041698
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20 -0.0366032565 0.0357864850
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orbital 1 8 53 0.3109098532 1.0000000000
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1 -0.0440947014 0.0282705656
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3 0.0706453804 -0.0452956501
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4 0.0050379249 -0.0032296012
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18 -0.0098614082 -0.2117420507
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20 0.0035460944 0.0761697266
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orbital 1 8 54 0.3773421405 1.0000000000
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20 0.1587208537 -0.0435370543
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orbital 1 8 56 0.7800487473 1.0000000000
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3 -0.0175100738 -0.1011337921
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4 0.0038769246 0.0223919065
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orbital 1 8 57 0.8836158666 1.0000000000
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1 -0.1390318328 0.0670236908
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4 0.0300412584 -0.0144822600
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orbital 1 8 58 0.9562857461 1.0000000000
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20 -0.1657691038 0.1109196384
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3 -0.0357662806 -0.0895557381
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4 -0.0266470260 -0.0667212581
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5 0.0077026363 0.0192843271
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20 0.1004614471 0.0145265342
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3 0.1109265291 0.1478261082
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4 0.0436410948 0.0581601310
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20 0.1012129839 -0.0122227818
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1 -0.0319794138 -0.0158958855
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4 -0.0829603423 -0.0412322164
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1 0.0311197367 0.1000939804
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3 0.0185550238 0.0596816000
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orbital 1 8 70 2.3518400418 1.0000000000
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orbital 1 8 73 2.6589769008 1.0000000000
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20 0.0513734612 -0.0742871426
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orbital 1 9 71 2.5097617326 1.0000000000
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1 -0.0166038275 -0.0487656030
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2 0.0197400023 0.0579772229
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3 -0.0009152000 -0.0026943661
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4 -0.0086646625 -0.0254535168
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5 0.0207468780 0.0609409850
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7 0.0070266916 0.0206375584
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8 -0.0010087135 -0.0029549113
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9 0.0024353519 0.0071544155
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10 0.0253316398 0.0743999462
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11 0.0033347878 0.0097902893
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12 0.0131711979 0.0386883779
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13 0.0159285228 0.0467895610
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14 -0.0236718809 -0.0695234654
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15 0.0294950914 0.0866325069
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17 0.0487662499 0.1432428889
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18 0.0246381379 0.0723702715
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19 -0.0057231985 -0.0168061178
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20 0.0309238992 0.0908282803
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orbital 1 9 72 2.5756095656 1.0000000000
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1 -0.1182993115 0.0266711817
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2 0.1975167627 -0.0445319145
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3 -0.1753463010 0.0395344182
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17 0.3258791400 -0.0734726224
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18 0.2142702147 -0.0483088064
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20 -0.0009807609 0.0002215400
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1 -0.0011623993 0.0044630300
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2 0.0190912014 -0.0733872226
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18 0.0046481447 -0.0178646813
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20 0.0060064560 -0.0230911731
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orbital 1 9 74 2.9991202224 1.0000000000
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1 -0.0077194880 0.1015975246
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2 0.0038177111 -0.0502444683
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3 -0.0075726153 0.0996619782
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20 -0.0239475545 0.3151737001
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1 0.0434649378 0.0520027650
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2 -0.0685513621 -0.0820169839
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3 -0.0810880495 -0.0970171480
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4 0.0466702591 0.0558392009
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8 0.0786627877 0.0941169386
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18 -0.0630565410 -0.0754467198
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19 0.2744031625 0.3283135830
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20 0.0247668600 0.0296340959
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1 0.0035503909 0.0002247882
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2 -0.3521262319 -0.0222747974
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3 -0.0988079988 -0.0062516272
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6 0.0256781181 0.0016241850
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8 0.0073694967 0.0004675935
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9 0.3347573408 0.0211791324
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15 0.0011792181 0.0000754594
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18 -0.0440525540 -0.0027860492
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20 -0.2273195049 -0.0143785918
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1 0.0170326638 0.0685136035
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8 0.0100314076 0.0403515724
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1 -0.0484776587 -0.1016186941
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2 0.0520580323 0.1091223212
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10 0.0827055663 0.1733704904
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11 0.0764812590 0.1603180966
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12 0.0683905307 0.1433618515
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13 -0.0325125525 -0.0681470016
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14 0.0220086649 0.0461340637
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15 0.1966860959 0.4122951719
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17 0.0211003211 0.0442335871
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18 0.0031178892 0.0065395476
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20 -0.0994682850 -0.2085050692
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2 0.2060903625 -0.1252269684
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8 0.0466346534 -0.0283343377
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17 0.0772105811 -0.0469145833
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18 0.0387903405 -0.0235664241
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1 -0.0931269321 0.0356686232
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2 0.1660505351 -0.0635958479
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3 0.0647534370 -0.0248016699
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7 0.1549997237 -0.0593614999
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18 0.0998965386 -0.0382578977
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20 0.2565898002 -0.0982712055
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1 -0.0334735722 0.0205874246
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2 0.1765931642 -0.1085807084
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3 0.1061858876 -0.0652954743
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20 0.2122062745 -0.1304757235
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1 0.1145049468 -0.0093687862
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2 -0.2458435277 0.0201121394
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18 0.0681132651 -0.0055712052
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1 0.0625503459 -0.0155897745
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10 0.2705346219 -0.0674269930
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17 0.2391326774 -0.0596004570
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18 0.0581332360 -0.0144897176
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1 0.0795439343 -0.0293206209
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2 0.3361938172 -0.1239203691
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3 -0.0558235876 0.0205764574
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5 0.2702637773 -0.0996177131
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20 -0.0829536617 0.0075235269
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orbital 1 11 24 -20.6403182273 1.0000000000
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orbital 1 11 26 -13.9113620149 1.0000000000
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orbital 1 11 27 -13.3555186408 1.0000000000
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orbital 1 11 29 -13.0316263397 1.0000000000
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20 -0.0091099966 -0.0035972535
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orbital 1 11 30 -13.0034910772 1.0000000000
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orbital 1 11 31 -12.9353084381 1.0000000000
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20 -0.0082375174 -0.0060849404
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orbital 1 11 33 -12.8894920112 1.0000000000
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13 -0.0175709063 0.0142830393
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15 -0.0762516921 0.0619806525
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18 0.0080765976 -0.0211543255
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19 -0.0050110083 0.0131236287
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20 0.0350433197 -0.0918032975
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orbital 1 11 58 0.6185374444 1.0000000000
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1 -0.1183097022 0.1579475285
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2 0.0850625127 -0.1135690545
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4 0.0031238516 -0.0041654695
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11 -0.0013627151 -0.0010228286
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12 -0.0975309713 -0.0730568270
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13 -0.0466862542 -0.0349693643
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14 0.0381309574 0.0285613795
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15 0.0329536473 0.0246860209
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17 0.1209926492 0.0145006418
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18 -0.0579166224 -0.0069418707
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19 0.0473025339 0.0056699455
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20 0.0408824334 0.0048977911
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orbital 1 11 59 0.9460745581 1.0000000000
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1 -0.1271599445 -0.1366420017
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2 -0.0380221778 -0.0408562843
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8 -0.0231724175 -0.0071092430
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19 0.0230282927 -0.0750493193
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20 0.0612760659 -0.1996976245
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orbital 1 11 60 1.0523654359 1.0000000000
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1 -0.0854786043 -0.0211880279
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2 -0.0546791478 -0.0135528068
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18 -0.0070146262 -0.0243352921
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19 0.0190105774 0.0659507308
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20 -0.0132676953 -0.0460372646
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orbital 1 11 61 1.4636753385 1.0000000000
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1 -0.0098015569 0.0290306433
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20 -0.0397431781 0.0079719143
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orbital 1 11 62 1.4830120392 1.0000000000
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19 0.0105560873 0.0047652914
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20 0.0991258114 0.0447537535
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orbital 1 11 63 1.8775624035 1.0000000000
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1 -0.0137910333 0.0053782316
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2 -0.0386873576 0.0150623030
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19 -0.0907188857 -0.0727035040
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20 -0.1313610765 -0.1052824985
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orbital 1 11 64 1.8841997807 1.0000000000
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1 -0.0441373811 -0.0014283922
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8 0.0092398687 -0.0049510540
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20 -0.0090440929 -0.0168807654
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orbital 1 11 65 1.9711844771 1.0000000000
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1 0.0071419635 0.1280377092
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3 -0.0030365320 -0.0544517360
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8 0.0298556126 0.0456390074
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11 0.0171241032 -0.0009537964
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19 -0.0076051577 0.0049751256
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20 -0.1227311153 0.0802925760
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orbital 1 11 66 2.0578194353 1.0000000000
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1 -0.0285302418 -0.0544812367
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2 -0.0381913150 -0.0729264356
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4 0.0398094142 0.0760172945
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9 0.0724839746 0.0459270792
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18 0.0314011313 -0.0495629696
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20 0.0461383958 -0.0728163446
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orbital 1 11 67 2.3694093205 1.0000000000
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1 0.0205057077 0.0100118985
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2 -0.0130214476 -0.0063590757
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3 0.0386569003 0.0188750681
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20 0.0027721018 0.0399124792
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orbital 1 11 68 2.4480812320 1.0000000000
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2 -0.0443669787 -0.0147734825
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3 0.0647327892 0.0215576717
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20 -0.0007824583 -0.0038006488
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orbital 1 11 69 2.5001527264 1.0000000000
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1 0.0124871319 -0.0144572912
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2 -0.0292888238 0.0339150078
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3 0.0735015548 -0.0851004834
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20 -0.0398870128 -0.0076250987
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orbital 1 11 70 2.5546196071 1.0000000000
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orbital 1 11 71 2.5795123337 1.0000000000
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1 -0.0167737660 -0.0059060755
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20 -0.0009645938 -0.0006487916
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orbital 1 17 51 -0.1661681592 1.0000000000
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1 0.0110935807 0.0557130616
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2 0.0213631335 0.1072537286
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3 0.0282482672 0.1418126019
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4 -0.0235432492 -0.1182023191
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5 -0.0011350003 -0.0056990044
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6 0.0161004693 -0.0474785832
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7 -0.0299542577 0.0883125946
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8 -0.0147161543 0.0433919757
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9 0.0141936453 -0.0418441606
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10 0.0307725236 -0.0907313491
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11 0.2664453830 -0.0530736069
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12 -0.0532424842 0.0106081341
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13 -0.1145069721 0.0228062526
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14 0.0064141757 -0.0012789995
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15 0.0790812299 -0.0157514002
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16 0.1022214110 0.0346695607
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17 -0.0263623163 -0.0089390927
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18 -0.0984468436 -0.0333910169
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19 0.0709543863 0.0240629283
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20 0.0197353052 0.0066965662
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orbital 1 17 52 -0.1115171081 1.0000000000
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1 -0.2227425723 0.0171726243
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2 0.0215937687 -0.0016665729
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3 0.0316786412 -0.0024448431
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4 0.0374975136 -0.0028890216
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5 -0.0071256244 0.0005507396
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7 -0.0412249841 -0.0197451260
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8 0.1795999537 0.0860143993
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9 0.0104606601 0.0050100266
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10 0.0030282888 0.0014523550
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11 0.0009326082 0.0121558362
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12 0.0089989960 0.1167052027
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13 -0.0073588708 -0.0954683220
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18 0.0086535803 -0.0180629568
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20 -0.0944067468 0.1971211597
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orbital 1 17 53 0.0527304229 1.0000000000
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1 -0.1035817590 -0.0608212984
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2 0.0474545943 0.0278617907
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3 -0.0144241473 -0.0084678387
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4 0.0239157831 0.0140428089
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5 0.1113595526 0.0653844024
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8 -0.0439046316 -0.0773427971
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9 -0.0130252388 -0.0229495670
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12 -0.0158636385 0.0270149333
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13 -0.0220828304 0.0376136467
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18 -0.0347515305 0.0197252756
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19 0.0022222724 -0.0012606790
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20 0.0290054313 -0.0164651915
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orbital 1 17 54 0.1259558831 1.0000000000
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1 -0.0239333887 -0.0168437838
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2 -0.0719964673 -0.0506600817
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3 0.0941220869 0.0662316502
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4 0.0038331129 0.0026976755
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5 -0.0764477460 -0.0537918170
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6 0.0887414039 0.1914726370
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7 0.0392114007 0.0846032449
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8 0.0288428174 0.0622268147
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9 -0.0200714293 -0.0433070423
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10 -0.0115087010 -0.0248300339
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12 -0.0560724197 0.0796833613
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13 0.0586608602 -0.0833660931
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17 0.0704119621 -0.0326319093
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18 -0.0845314938 0.0391781414
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20 -0.0505057447 0.0234089666
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orbital 1 17 55 0.5893655448 1.0000000000
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1 -0.0001916403 0.0008524699
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2 0.0074660139 -0.0327527929
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3 -0.0331156954 0.1453043046
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4 -0.0286745098 0.1258126915
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5 0.0021973091 -0.0096346494
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6 -0.0989087450 0.1066684867
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7 -0.0894619792 0.0964755231
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8 0.0335454384 -0.0361753102
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13 -0.0668064701 -0.0152273857
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14 0.0586072661 0.0133590015
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18 -0.0797995645 -0.0739970565
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20 -0.0361828922 -0.0335506420
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orbital 1 17 56 0.6585556117 1.0000000000
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1 -0.0422650843 -0.1012165528
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2 -0.0419210059 -0.1003971854
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3 -0.0346305730 -0.0829347199
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4 -0.0100569246 -0.0240790356
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5 -0.0252226372 -0.0604026962
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8 0.0223505689 -0.1735812218
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9 0.0011519342 -0.0089550397
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18 0.0082150945 0.0010568517
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20 -0.0241671957 -0.0031123014
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orbital 1 17 57 0.8296926953 1.0000000000
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1 0.2240268834 -0.0917945979
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2 -0.0159071442 0.0065228035
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3 -0.0758924849 0.0311012688
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4 0.0937456459 -0.0384179278
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12 0.0396471739 0.0967621823
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20 -0.0200287227 0.1477781818
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orbital 1 17 58 0.8633543616 1.0000000000
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1 -0.1276145703 0.0127018144
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4 0.0661646214 -0.0065919814
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6 0.0144761106 0.0065415839
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7 0.0314529286 0.0142154368
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8 0.1156770714 0.0522651663
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9 0.0932434987 0.0421246908
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12 -0.0090763111 -0.0911788928
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18 -0.0390440057 0.0864238608
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20 0.0367989238 -0.0814374971
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orbital 1 17 59 1.1110051683 1.0000000000
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1 -0.1119915877 0.0236537114
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2 -0.0060232834 0.0012703720
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3 -0.1284859052 0.0271392953
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4 0.0520387404 -0.0109912113
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5 0.0929969676 -0.0196428156
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7 0.0654862664 0.0213694062
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9 -0.0290028532 -0.0094664345
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10 0.0693375900 0.0226307728
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12 0.0266990004 0.1264121242
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13 0.0174122358 0.0824392663
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14 -0.0025535474 -0.0120857623
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15 0.0047575534 0.0225140098
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20 -0.0558420493 0.1711171054
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orbital 1 17 60 1.1515501800 1.0000000000
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1 -0.0148105366 -0.0068155514
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2 -0.1327220839 -0.0610667354
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3 0.0456388766 0.0209952458
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4 0.0415118335 0.0191007066
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5 0.0168895843 0.0077715066
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6 -0.0671275670 -0.0948337886
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7 -0.0305305489 -0.0431308545
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8 0.0217112050 0.0306701103
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10 0.1308102987 0.1848012426
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20 0.0528045598 -0.0373801729
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orbital 1 17 61 1.3549073742 1.0000000000
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1 -0.0847346247 -0.1909194540
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2 0.0360714153 0.0812751589
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3 0.0082433998 0.0185677375
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4 -0.0320721970 -0.0722672036
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5 -0.0163016641 -0.0367289378
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6 0.0146063539 -0.1374251140
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7 0.0013800957 -0.0129863030
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19 -0.1888378217 -0.0200716142
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20 -0.0278795577 -0.0029623893
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orbital 1 17 62 1.3902589219 1.0000000000
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1 -0.0025733017 -0.0203705628
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2 0.0055800722 0.0441980711
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3 0.0101624740 0.0805002826
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4 0.0085206450 0.0674919398
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5 0.0033831174 0.0267991193
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6 0.0276427360 -0.0657464695
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7 0.0052893625 -0.0125790460
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8 -0.0197863220 0.0470609593
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9 -0.0831568457 0.1977772494
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10 0.0203417439 -0.0483758732
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18 -0.0066847913 -0.0028099635
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19 0.0033851647 0.0014256312
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20 -0.0828691550 -0.0348428838
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orbital 1 17 63 1.6083438122 1.0000000000
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2 -0.0839426711 0.0253898786
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3 -0.1722473811 0.0521006870
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4 -0.1328353142 0.0401799565
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5 -0.0486306217 0.0147101255
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6 0.1327359799 0.0310596732
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7 -0.0287914116 -0.0067371812
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8 -0.0343860170 -0.0080467315
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9 0.0137019592 0.0032075992
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10 -0.1411772406 -0.0330361051
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11 0.0356894945 0.1179807099
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12 0.0200773844 0.0663814853
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13 -0.0200741065 -0.0663612863
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14 0.0271499472 0.0897619815
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20 0.0109880590 -0.0469666293
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orbital 1 17 64 1.6712842435 1.0000000000
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1 0.0750389252 -0.0995393975
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2 -0.0606047742 0.0803896961
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3 -0.0331202427 0.0439325136
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4 -0.0455909551 0.0604721642
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5 0.0979446750 -0.1299240090
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6 -0.0727185742 0.0308491479
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7 0.1567185321 -0.0664870977
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9 0.1474449309 -0.0625515049
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18 0.0136796600 0.0322458529
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20 0.0506887789 0.1194789606
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1 0.0769315022 -0.0489331582
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2 0.0880292593 -0.0559920429
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3 -0.0828342654 0.0526884424
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4 0.0003870946 -0.0002437531
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5 0.0810396287 -0.0515448267
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3 0.0262202144 -0.0076484090
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3 0.0274337941 0.0422236288
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5 0.0184177938 0.0283477815
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orbital 1 17 68 2.1899680637 1.0000000000
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1 0.0275736611 0.0101197585
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2 -0.0930454132 -0.0341387491
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3 -0.0320507126 -0.0117620227
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4 0.0159997440 0.0058709582
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5 0.0027708356 0.0010159133
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6 -0.0302107306 -0.0361961678
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7 0.1550198755 0.1857238064
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8 0.0651507585 0.0780587978
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9 -0.0721028442 -0.0863852957
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10 -0.0577805117 -0.0692238279
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11 -0.0382923578 0.1043572192
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12 0.0255354213 -0.0695909935
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14 -0.0189995815 0.0517831374
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15 0.0086009254 -0.0234427320
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16 0.0319968768 -0.0267101893
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17 0.0823979118 -0.0687778560
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18 -0.0496140590 0.0414143191
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19 0.0260183115 -0.0217143163
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20 -0.0927546340 0.0774185542
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orbital 1 17 69 2.2683233329 1.0000000000
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1 0.0141972192 0.0013810751
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2 0.0281237086 0.0027332479
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3 -0.0042831449 -0.0004163364
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4 0.1052994070 0.0102317544
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5 0.0817703388 0.0079434800
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6 -0.1088776464 -0.0778058196
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7 0.0606531013 0.0433404980
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8 0.0650353587 0.0464795849
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9 0.0306869782 0.0219356842
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10 -0.0140478918 -0.0100438117
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11 -0.0016819641 0.0172949309
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12 0.0025558445 -0.0262946361
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13 -0.0002123701 0.0022005165
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14 0.0011356414 -0.0117357624
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15 0.0097718086 -0.1005228988
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17 -0.0758624873 0.1061599571
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18 -0.0643294999 0.0900197853
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19 0.1190328043 -0.1665671915
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20 0.0466507594 -0.0652796684
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orbital 1 17 70 2.3067633045 1.0000000000
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1 0.0069439634 0.0341748113
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2 -0.0021616420 -0.0106377685
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3 0.0009583904 0.0047146276
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4 0.0008068921 0.0039827090
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5 -0.0156709635 -0.0771324653
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6 0.0171920282 -0.0513082139
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7 0.0248348752 -0.0741517286
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9 -0.0651662995 0.1945526240
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16 -0.0843304983 -0.0282451409
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17 0.0074675315 0.0024974033
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18 0.0168203955 0.0056289141
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19 -0.0453846766 -0.0151960355
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20 -0.0244042114 -0.0081687851
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orbital 1 17 71 2.5455192623 1.0000000000
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1 -0.0057124126 0.0237493326
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2 -0.0189699136 0.0788918914
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3 -0.0036161993 0.0150258808
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4 0.0269952419 -0.1122793491
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5 -0.0223264686 0.0928585713
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8 0.0033984153 -0.0035772334
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9 0.0356583224 -0.0375477957
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11 0.0425257979 0.0102240145
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12 -0.0116980831 -0.0028124202
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13 0.0964459953 0.0231897202
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14 -0.1418677247 -0.0341143804
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15 -0.0516811835 -0.0124299567
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17 0.0095586203 0.0090759302
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|
18 -0.0541221498 -0.0513975859
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19 0.0383340801 0.0364051664
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20 -0.0405599941 -0.0385168531
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|
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orbital 1 17 72 2.6179357131 1.0000000000
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1 0.0155808893 0.0746921077
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2 -0.0035111409 -0.0168185419
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3 0.0196624845 0.0943030063
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4 0.0357836316 0.1715913571
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5 -0.0091773757 -0.0440029864
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6 -0.0026796435 0.0081347839
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7 -0.0103833417 0.0315370995
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8 0.0251414572 -0.0763622310
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9 0.0207799265 -0.0631127536
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10 0.0097470567 -0.0296098899
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11 -0.0233998491 0.0048799443
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12 0.0546254535 -0.0113867308
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13 0.0035876733 -0.0007464600
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15 -0.0750683105 0.0156524362
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16 0.0044643089 0.0014692488
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17 0.0083549532 0.0027509475
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18 -0.0176080681 -0.0057993497
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19 0.0050838502 0.0016727238
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20 0.0137103344 0.0045123899
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orbital 1 17 73 3.2366126720 1.0000000000
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1 -0.0850355484 0.0448162295
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2 0.0216214628 -0.0113942652
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3 0.0899477642 -0.0474058550
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4 -0.0798139177 0.0420632369
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5 0.2581563687 -0.1360582830
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6 0.0286974368 0.0011064671
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7 0.1448286430 0.0055886529
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8 -0.0229263103 -0.0008841650
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9 0.0547661554 0.0021141116
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10 -0.1191064172 -0.0045942393
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11 0.0449065247 0.0852045611
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12 0.1183473442 0.2245511209
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13 0.0003905040 0.0007422213
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14 -0.0574793921 -0.1090629758
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15 0.0617911331 0.1172431824
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18 0.0011241625 -0.0291115911
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19 -0.0177567270 0.4602938302
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20 0.0146189530 -0.3789314729
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|
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orbital 1 17 74 3.2770018375 1.0000000000
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1 -0.0261230169 -0.1408255830
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2 0.0183463984 0.0989030788
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3 -0.0030381151 -0.0163719446
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4 -0.0418875982 -0.2258065869
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5 0.0084788813 0.0457073357
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7 -0.0227820271 0.0643700834
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9 -0.0155419378 0.0439111618
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10 -0.0185174971 0.0523227614
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13 -0.1136932575 0.0210899077
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14 0.0378435246 -0.0070198880
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15 0.3573170515 -0.0662830332
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17 0.2338686015 0.0827750444
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18 0.1462110450 0.0517502955
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19 -0.2281793818 -0.0807633899
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20 0.1949393633 0.0689990117
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|
|
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orbital 1 17 75 3.2923630197 1.0000000000
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1 0.0029853793 0.0162401938
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2 -0.0218144006 -0.1186413641
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3 0.0032284930 0.0175617535
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4 0.0167560134 0.0911309229
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5 0.0019958605 0.0108499793
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6 -0.0150596789 0.0423393013
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7 0.0864547137 -0.2430410525
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8 0.0089268997 -0.0250916307
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12 0.0290997194 -0.0053493665
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13 0.0389390833 -0.0071605871
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14 0.1869917545 -0.0343803334
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17 -0.0566348741 -0.0201459422
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18 0.0424215243 0.0150899321
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19 -0.0909486236 -0.0323524366
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20 -0.0764675328 -0.0272020094
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orbital 1 17 76 3.3553925856 1.0000000000
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1 -0.1511176711 0.0332271133
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2 0.4036286886 -0.0887474351
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3 0.1107334827 -0.0243469154
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4 0.1391159754 -0.0305897607
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5 -0.4729695382 0.1039951710
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7 0.2597226491 0.0823859260
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9 -0.0480291740 -0.0152350836
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10 -0.1261352332 -0.0400126243
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12 0.0039371122 0.0179098448
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13 0.0251379678 0.1143328776
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14 -0.0681227630 -0.3098221424
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15 0.0243664751 0.1108217602
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17 0.0196486647 -0.0619417624
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18 0.0346519812 -0.1092411636
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20 -0.0259078556 0.0816777634
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orbital 1 17 77 3.4316672328 1.0000000000
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1 0.0009648926 0.0137789339
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2 -0.0126108292 -0.1803571477
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3 -0.0101407582 -0.1451036292
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4 -0.0299139411 -0.4280956335
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10 0.0444801986 -0.0912052423
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14 0.2574656038 -0.0180029823
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15 0.1222780925 -0.0085436144
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17 0.0199872287 0.0097498119
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18 -0.1246839383 -0.0608169911
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19 0.2547432911 0.1242586448
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20 0.2824846689 0.1377933580
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orbital 1 17 78 3.4474503968 1.0000000000
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1 0.0017422804 -0.0562664144
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2 -0.0127337243 0.4113349424
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3 0.0017050527 -0.0549801967
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4 0.0061707096 -0.1990047580
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5 0.0016723915 -0.0538498809
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6 0.0078731055 -0.0127142144
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7 -0.0603371243 0.0974115703
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8 0.0828715136 -0.1337952768
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9 0.1492460135 -0.2409591605
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12 -0.1973298885 -0.0061158605
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13 0.1558930979 0.0048255640
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18 -0.0022500670 -0.0013960319
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20 0.0884740768 0.0548083792
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orbital 1 17 79 3.5529059371 1.0000000000
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1 0.0469025733 -0.0586314690
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2 -0.0489366959 0.0611746206
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3 -0.0344253990 0.0430379299
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4 -0.0041291504 0.0051601455
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5 0.0705822504 -0.0882300005
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6 0.0050199935 -0.0019609816
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7 0.0243046065 -0.0094973407
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9 0.0342927758 -0.0133975752
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10 0.1431407692 -0.0559242391
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11 0.0907203112 0.0725750108
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12 0.3068463791 0.2454756625
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13 0.0123720280 0.0098983789
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14 -0.0663844933 -0.0531061279
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17 -0.1721890441 -0.4407257703
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18 -0.0821401280 -0.2102387119
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19 0.0762362824 0.1951257390
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20 0.0606332002 0.1551837560
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orbital 1 17 80 3.5914036363 1.0000000000
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1 -0.0808003197 0.1112269647
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2 0.2159021617 -0.2971969093
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3 -0.0160948526 0.0221576438
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4 -0.0770757551 0.1061044461
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6 0.2148972338 -0.0956956879
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7 -0.4849789034 0.2159619992
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8 0.2161185986 -0.0962330598
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9 0.2084830998 -0.0928380521
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10 -0.1557715077 0.0693668169
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11 0.0431955903 0.0313815988
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12 0.0503072836 0.0365451802
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13 -0.0264618226 -0.0192229112
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14 -0.0070412978 -0.0051166208
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18 -0.0120921376 -0.0271592917
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19 -0.0005230441 -0.0011730534
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20 0.0327810797 0.0736291072
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orbital 1 17 81 3.7263799485 1.0000000000
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1 0.0048342265 0.0404866096
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2 0.0113435730 0.0950126923
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3 -0.0070804117 -0.0593906287
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4 -0.0050553738 -0.0424757756
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5 0.0080209486 0.0672288964
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6 0.0241517003 -0.0563897989
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7 0.0141981622 -0.0331687856
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8 -0.0273634354 0.0638905057
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9 -0.0335676121 0.0783826603
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10 -0.1183184977 0.2762845651
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12 -0.1687416025 0.0201712236
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13 -0.2223165464 0.0265662482
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14 0.2484382986 -0.0296869764
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15 0.2781937738 -0.0332521085
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17 -0.2945418471 -0.1261632875
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18 -0.0394591078 -0.0169022239
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20 -0.2753087489 -0.1179386104
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orbital 1 17 82 3.7385091569 1.0000000000
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1 -0.0341729574 0.0297831768
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2 -0.1040225916 0.0906553212
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3 0.2189051618 -0.1907824775
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4 0.2927926777 -0.2551826159
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5 -0.1584500790 0.1380939797
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6 -0.0103654298 0.0020316138
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7 -0.2092341098 0.0409551873
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8 0.0870216922 -0.0170337521
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9 0.0742079488 -0.0145266828
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10 0.2592381490 -0.0507571656
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11 -0.0280650921 -0.0321911647
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12 0.0897215311 0.1029333826
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14 -0.0157750753 -0.0180811455
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20 -0.0590194400 -0.3016346734
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orbital 1 17 83 3.8294142082 1.0000000000
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1 0.0014647365 0.0648312336
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2 0.0059422687 0.2627077325
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3 0.0025256254 0.1116550938
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4 0.0019115051 0.0846427753
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5 0.0096274152 0.4255949660
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6 0.0321517566 -0.0587166489
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7 0.0610278458 -0.1114548498
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8 0.0313549416 -0.0572678478
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9 0.0795242408 -0.1452378595
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18 -0.1829183409 -0.1001610673
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20 0.1416101354 0.0775398291
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orbital 1 17 84 3.8487707136 1.0000000000
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1 -0.0945119441 -0.0233159315
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2 -0.1404589009 -0.0346542513
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3 -0.0776271666 -0.0191529421
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4 -0.1952474494 -0.0481683341
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5 -0.1870137761 -0.0461407540
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9 -0.1919264254 -0.1844231629
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10 0.2382197886 0.2289048525
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12 0.0396322180 -0.1606544878
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13 -0.0292264927 0.1184750448
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17 -0.0723372204 0.0752759725
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18 0.0486756172 -0.0506535892
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19 -0.1121841200 0.1167450960
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20 -0.0251531117 0.0261720825
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orbital 1 17 85 4.5075953374 1.0103453413
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1 0.0172406745 -0.2260743387
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2 0.0013805655 -0.0180929142
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3 -0.0180267471 0.2363099535
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4 0.0018749881 -0.0246078215
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5 -0.0029949715 0.0392762207
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6 -0.2338506065 0.3419590619
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20 0.0022041949 0.0106592857
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orbital 1 18 36 -12.8020336058 1.0000000000
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5 0.0017303401 -0.0013774588
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orbital 1 18 37 -1.7343306684 1.0000000000
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orbital 1 18 38 -1.6928043708 1.0000000000
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orbital 1 18 40 -1.6010978538 1.0000000000
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17 -0.0879340277 0.0772562679
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19 -0.0700326301 0.0615274993
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20 0.0122842705 -0.0107925539
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orbital 1 18 53 0.0527303446 1.0000000000
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1 0.1004013255 -0.0415596116
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2 -0.0211214089 0.0087395801
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3 0.0821760413 -0.0340081222
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4 0.0243819744 -0.0100926515
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5 -0.0234021790 0.0096841270
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6 -0.0459366333 -0.1109885451
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7 0.0210432082 0.0508468101
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8 0.0063960918 0.0154550711
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9 -0.0106058580 -0.0256250732
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10 -0.0493826696 -0.1193208226
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11 0.0976589011 0.2359661164
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12 -0.0493193366 -0.1191593355
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13 -0.0152829833 -0.0369206226
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14 0.0009777762 0.0023603682
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17 -0.0289455161 0.0119815154
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19 -0.0610834750 0.0252800062
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20 -0.1449747057 0.0600059219
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orbital 1 18 54 0.1259559066 1.0000000000
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1 0.1791545116 -0.1115371481
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2 0.0791603666 -0.0492820577
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3 -0.0582266640 0.0362462339
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4 0.0405210542 -0.0252270706
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5 0.0232333806 -0.0144626199
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19 0.0129728355 -0.0080754538
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20 -0.1509948004 0.0940087433
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orbital 1 18 55 0.5893654221 1.0000000000
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1 -0.1303737329 -0.0645259330
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2 -0.1179208133 -0.0583584526
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3 -0.0442181846 -0.0218823803
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4 0.0519011725 0.0256867876
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6 0.0003898159 -0.0007826009
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20 -0.0410405877 -0.0203123908
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orbital 1 18 56 0.6585554513 1.0000000000
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1 -0.1641032859 0.0886049125
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2 0.1261262783 -0.0681029508
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3 0.1539988346 -0.0831516355
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4 0.0079461357 -0.0042901404
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5 0.0549693545 -0.0296800829
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7 -0.0516906057 -0.0957338913
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8 0.0426991066 0.0790842805
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9 0.0123958475 0.0229620176
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10 0.0310990036 0.0575976051
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12 -0.0221711916 -0.0410660002
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13 0.0039343501 0.0072892144
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20 -0.0410207260 0.0221496735
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orbital 1 18 57 0.8296925856 1.0000000000
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1 -0.0272062186 0.0671879492
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2 -0.0541682714 0.1337726013
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3 0.0422855030 -0.1044289280
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5 -0.0431308614 0.1065147032
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6 0.2244039153 0.0908682783
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8 0.0760220072 0.0307839097
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20 -0.0594895375 0.1469109343
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orbital 1 18 58 0.8633544986 1.0000000000
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1 0.0148841236 0.0055539772
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2 0.0323372453 0.0120662198
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3 -0.1189273865 -0.0443768415
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4 -0.0958602670 -0.0357689505
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6 0.0448335112 -0.1201530147
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17 0.0858483379 0.0320323683
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20 -0.0124815532 -0.0046596015
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orbital 1 18 59 1.1110052447 1.0000000000
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1 0.0044304740 -0.0089703264
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2 0.0304774352 -0.0617766357
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3 0.0445152591 -0.0902311136
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4 0.0134961738 -0.0273610426
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8 0.1177702446 0.0581004257
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20 0.0101860190 -0.0206355328
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orbital 1 18 60 1.1515503512 1.0000000000
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1 0.0097246556 -0.1157793886
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3 0.0031475870 -0.0374465782
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5 0.0189471513 -0.2256192988
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6 0.0162467296 0.0013606576
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7 0.1455842648 0.0122269239
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8 0.0500598711 0.0042098789
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9 0.0455362856 0.0038216803
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20 0.0107923780 -0.1284868043
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orbital 1 18 61 1.3549073896 1.0000000000
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1 0.0498194888 0.1289074815
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3 -0.0012155416 -0.0031433515
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4 0.0098704611 0.0255295044
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9 0.0737473529 -0.0285018095
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19 -0.0198651306 -0.0513950096
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20 0.0018919818 0.0048994016
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orbital 1 18 62 1.3902590331 1.0000000000
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1 -0.0707924213 -0.0086737889
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3 -0.0506727826 -0.0062100331
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18 0.0487453075 0.0059746740
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20 -0.0208763566 -0.0025591877
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orbital 1 18 63 1.6083437456 1.0000000000
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1 -0.1231431279 -0.0584675839
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2 0.0267087355 0.0126804534
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3 -0.0319000551 -0.0151459709
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4 0.0127135532 0.0060358409
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20 -0.1513809946 -0.0718736591
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3 -0.0142509992 0.0106598960
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4 0.1282549161 -0.0959353688
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7 0.0603027937 0.0806163089
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11 0.0761627804 0.1018196040
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12 0.0287560481 0.0384425074
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13 0.0209809189 0.0280469629
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14 -0.0038249969 -0.0051156253
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20 -0.0341269674 0.0255294035
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1 -0.1373310960 0.0075070939
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2 -0.0316608884 0.0017284769
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3 -0.0955876219 0.0052260158
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4 0.0030758202 -0.0001686181
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6 0.0049766761 0.0910390719
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7 0.0056936073 0.1041716788
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8 0.0053590503 0.0980257533
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20 0.1023563412 -0.0055939097
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orbital 1 18 66 1.8928840498 1.0000000000
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1 -0.1642025387 0.0020551806
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2 -0.0984000915 0.0012318319
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3 0.0012649930 -0.0000162371
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4 0.0403267901 -0.0005041042
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12 0.0008506637 0.0680642624
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20 0.0752584152 -0.0009422432
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orbital 1 18 67 2.1414056544 1.0000000000
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1 0.0001408972 -0.0152352865
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2 0.0008031982 -0.0862294786
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3 -0.0009530978 0.1019832531
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6 0.0006432859 0.0293658593
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8 0.0007478225 0.0341328996
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3 0.0690761190 0.0402386294
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20 0.0872689192 0.0508398366
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orbital 1 18 70 2.3067631886 1.0000000000
|
|
1 0.0537027890 0.0066555997
|
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2 0.0776053401 0.0096321413
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3 0.1206048739 0.0149595879
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|
4 0.2036137577 0.0252603403
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|
5 -0.1465012094 -0.0181765460
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6 0.0042952103 -0.0346069937
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7 -0.0013366710 0.0107739804
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8 -0.0005924111 0.0047743816
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9 -0.0004941362 0.0040321078
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10 0.0096974837 -0.0781124886
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11 0.0109506518 -0.0882601150
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|
12 -0.0009759005 0.0078133245
|
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13 0.0021907795 -0.0175991437
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14 -0.0059063036 0.0474966673
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|
15 -0.0031773534 0.0255417838
|
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16 0.0215611511 0.0026752691
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|
17 -0.0341468809 -0.0042366229
|
|
18 0.0263862020 0.0032737493
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|
19 -0.0978697993 -0.0121447796
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20 0.0598650111 0.0074228086
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|
|
|
orbital 1 18 71 2.5455194623 1.0000000000
|
|
1 -0.0019493823 0.0028796200
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2 -0.0175660283 0.0259462190
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3 -0.0027691691 0.0040901238
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4 -0.0290300438 0.0428783053
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5 -0.0184947056 0.0273219161
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6 -0.0202262546 -0.0136952942
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7 -0.0671890957 -0.0454921136
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8 0.0127991185 0.0086636968
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|
9 -0.0956256984 -0.0647457525
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10 0.0790838319 0.0535465986
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11 0.0084660393 0.0057332332
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|
12 0.0109119996 0.0073881600
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|
13 0.0618052744 0.0418429670
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14 -0.0437744796 -0.0296362737
|
|
15 0.0463159280 0.0313581356
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|
16 -0.0245219624 0.0362228508
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|
17 0.0067447825 -0.0099625379
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|
18 0.0556136211 -0.0821386686
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|
19 -0.0818025981 0.1208240119
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20 -0.0298022088 0.0440192971
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|
|
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orbital 1 18 72 2.6179357238 1.0000000000
|
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1 -0.0082800424 -0.0022046034
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2 -0.0320875761 -0.0085353747
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3 -0.0776923224 -0.0206593047
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4 -0.0642158119 -0.0170783697
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5 -0.0301291380 -0.0080166348
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6 0.0196104680 -0.0737360609
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7 -0.0044171761 0.0166017818
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8 -0.0247578288 0.0930928774
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9 -0.0450532250 0.1693920364
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10 0.0115586524 -0.0434449075
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11 -0.0012059616 0.0045395323
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12 -0.0022619119 0.0085002223
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13 -0.0047624256 0.0179150321
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14 0.0013758662 -0.0051719279
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|
15 0.0037103347 -0.0139482827
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|
16 0.0231027994 0.0061496993
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|
17 -0.0539197385 -0.0143401716
|
|
18 0.0035434688 0.0009392911
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|
19 -0.1358486036 -0.0361273084
|
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20 -0.0741046665 -0.0197041923
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|
|
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orbital 1 18 73 3.2366129201 1.0000000000
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1 -0.0149790552 0.0245032891
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2 -0.0755953978 0.1236604241
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3 -0.0119652810 0.0195749773
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4 0.0285847824 -0.0467608087
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5 -0.0621701409 0.1016974529
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6 0.0820115688 0.0501363390
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7 -0.0208519119 -0.0127475517
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8 0.0867488490 0.0530310324
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|
9 -0.0769742991 -0.0470556569
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10 0.2489766824 0.1522046469
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11 -0.1092863241 -0.0668089091
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12 -0.2641332609 -0.1614705402
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13 -0.0248558934 -0.0151933534
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14 0.3930142070 0.2402573964
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15 -0.3235449331 -0.1977894267
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16 0.0502380495 -0.0821799076
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|
17 0.1323928505 -0.2165698476
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|
18 -0.0004363057 0.0007143916
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19 0.0643027502 -0.1051861811
|
|
20 -0.0691227141 0.1130743588
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|
|
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orbital 1 18 74 3.2770017482 1.0000000000
|
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1 0.0965632846 -0.0695309373
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2 -0.0554161176 0.0398988637
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3 0.0814512888 -0.0586482137
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4 0.0378061122 -0.0272123191
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5 0.0450454307 -0.0324280443
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6 0.0836936618 0.1162309080
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7 -0.0587803349 -0.0816306782
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8 -0.0097286349 -0.0135130216
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9 -0.1341957247 -0.1863727417
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10 0.0271633829 0.0377273469
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11 0.0453472444 0.0629761554
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12 0.1449645967 0.2013235020
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13 -0.0906315702 -0.1258647152
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14 0.1414404057 0.1964273924
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17 -0.3593449208 0.2587497745
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18 -0.0938379063 0.0675680048
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19 0.0312317633 -0.0224935588
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20 0.2949100973 -0.2123584511
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|
|
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orbital 1 18 75 3.2923629288 1.0000000000
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1 -0.0354167192 0.0276611052
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2 0.2032964643 -0.1587894834
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3 -0.0209888869 0.0163931760
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4 -0.4295507182 0.3355137145
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5 -0.3206131910 0.2504241928
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6 -0.0101632483 -0.0130141991
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7 0.0742528628 0.0950667100
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8 0.0109917115 0.0140712089
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|
9 0.0570336028 0.0730233721
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10 0.0067926069 0.0086956187
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11 0.0144144687 0.0184538726
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12 -0.0369999431 -0.0473748975
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13 -0.0277178813 -0.0354834471
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14 0.0594243743 0.0760744381
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15 0.0499570310 0.0639643661
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16 0.0646776792 -0.0505135291
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|
17 -0.0233132687 0.0182185184
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18 0.0312019194 -0.0243684302
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|
19 0.1498361842 -0.1170352451
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20 0.3027224003 -0.2364560698
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|
|
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orbital 1 18 76 3.3553926757 1.0000000000
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1 0.0380754659 -0.1091543115
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2 -0.0897404533 0.2572732738
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3 -0.0321103578 0.0920524407
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4 -0.0165939569 0.0475756020
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5 -0.0435826111 0.1249449205
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6 0.1460963674 0.0509601821
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7 -0.3902107474 -0.1361112230
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8 0.1070519161 0.0373422316
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9 0.1344897116 0.0469151615
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10 -0.4572472026 -0.1594956767
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11 -0.0423089329 -0.0147587219
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12 0.0613587961 0.0214008101
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13 -0.1082120570 -0.0377443142
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14 -0.0230948186 -0.0080568337
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15 0.0809053278 0.0282223823
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16 0.0330788917 -0.0948296020
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17 0.0060394362 -0.0173139493
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18 -0.0385548209 0.1105322413
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19 0.1044793968 -0.2995245497
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20 -0.0373745168 0.1071378528
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orbital 1 18 77 3.4316671538 1.0000000000
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1 -0.0054660440 -0.0389694764
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2 -0.0028278712 -0.0201481249
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3 0.0035804668 0.0255304639
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4 0.0102499935 0.0730823835
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5 -0.0140959715 -0.1004902970
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6 0.0136782595 -0.0019178894
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7 -0.1790490963 0.0251149501
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8 0.1440479514 -0.0202065947
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9 0.4249764077 -0.0596149933
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10 0.1993878003 -0.0279691736
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11 -0.0040004209 0.0005606015
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12 -0.0220221474 0.0030884164
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13 -0.1373785355 0.0192723514
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14 0.2806840634 -0.0393733489
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15 0.3112527821 -0.0436619154
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16 0.0003960454 0.0028192752
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17 0.0341625482 0.2435373064
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|
18 -0.0143808808 -0.1025239746
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|
19 0.0358516995 0.2555916868
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20 0.0170277908 0.1213857878
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|
|
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orbital 1 18 78 3.4474503769 1.0000000000
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1 0.0085270985 -0.0122853860
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2 -0.0653340403 0.0941343363
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3 -0.0897361113 0.1292918729
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4 -0.1616115372 0.2328468195
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5 0.1418402907 -0.2043606392
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6 0.0462457215 0.0320973732
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7 -0.3380793134 -0.2346494473
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8 -0.0451901582 -0.0313646590
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9 -0.1635671121 -0.1135241744
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10 -0.0442624321 -0.0307175100
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11 -0.0791125662 -0.0549105009
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12 -0.0074980438 -0.0052064438
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13 0.0021751571 0.0015101087
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14 -0.0748555808 -0.0519543036
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15 -0.0855013915 -0.0593421144
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16 0.0106910344 -0.0154029661
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17 0.1125681146 -0.1621898261
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18 0.0889309967 -0.1281288641
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|
19 -0.1998399441 0.2879249632
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20 0.1176081130 -0.1694473074
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|
|
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orbital 1 18 79 3.5529061618 1.0000000000
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1 0.0010499828 -0.0052868849
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2 0.0050679323 -0.0255996259
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3 0.0026920625 -0.0136035542
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4 -0.0071571808 0.0361139015
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5 -0.0298666769 0.1507489945
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6 0.0736496139 0.0145927691
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7 -0.0768483710 -0.0152253967
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8 0.0540602819 0.0107128818
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9 0.0064814077 0.0012849616
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10 -0.1108344097 -0.0219624477
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11 -0.2252157212 -0.0446232026
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12 -0.4641437411 -0.0919650193
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13 0.2214103871 0.0438690590
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14 -0.2054987314 -0.0407159383
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15 -0.1634292988 -0.0323826581
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16 -0.0225804601 0.1139606069
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17 -0.0763738347 0.3854579987
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18 0.0030788358 -0.0155393710
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19 -0.0165220104 0.0833887424
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20 -0.0043217815 0.0218086949
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orbital 1 18 80 3.5914034950 1.0000000000
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1 0.1790762746 -0.1525446526
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2 -0.4041385165 0.3442618405
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3 -0.1800942279 0.1534126028
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4 -0.1737310581 0.1479911586
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5 0.1298055965 -0.1105737635
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6 -0.0891501350 -0.1046553025
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7 0.2382083435 0.2796375578
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8 0.0177594954 0.0208480959
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9 0.0850428116 0.0998337851
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10 0.0235028145 0.0275889153
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11 -0.0035912292 -0.0042168033
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12 -0.0176274229 -0.0206971736
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13 0.0192770673 0.0226316765
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14 0.0008335961 0.0009774296
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15 -0.0522648245 -0.0613542215
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16 -0.0406455331 0.0346236663
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17 -0.0473379623 0.0403203293
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18 -0.0248976648 0.0212091740
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19 -0.0066278417 0.0056447593
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20 0.0444266800 -0.0378440638
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|
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orbital 1 18 81 3.7263797372 1.0000000000
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1 -0.0451654460 -0.0415165568
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2 -0.0265596527 -0.0244171232
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3 -0.0511679005 -0.0470396038
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4 -0.0627736545 -0.0577057438
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5 -0.2212653506 -0.2034020438
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6 -0.0275947783 0.0300195459
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7 -0.0647552081 0.0704474503
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8 -0.0404736398 0.0440347721
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9 -0.0289442744 0.0314953730
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10 0.0458173119 -0.0498493031
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11 0.0037864535 -0.0041217612
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12 -0.2168487275 0.2358983563
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13 0.0290511618 -0.0316042508
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14 -0.0030646800 0.0033335296
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15 0.2026932244 -0.2205045162
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16 0.0759671206 0.0698318867
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17 -0.1251122987 -0.1150130149
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18 0.1648354217 0.1515255915
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19 -0.1842066491 -0.1693301369
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20 -0.2062603603 -0.1896118677
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orbital 1 18 82 3.7385091066 1.0000000000
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1 -0.0105243437 0.0009100687
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2 -0.2124100836 0.0183712583
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3 -0.0883424074 0.0076411876
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4 -0.0753352666 0.0065163758
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5 -0.2631799612 0.0227593408
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6 -0.0039062158 -0.0451593484
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7 -0.0118918222 -0.1374677859
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8 -0.0250252949 -0.2892937686
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9 -0.0334728073 -0.3869427903
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10 0.0181119734 0.2093988915
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11 0.0082295829 0.0951389946
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12 -0.0089956636 -0.1039227697
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13 0.0014661771 0.0169474658
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14 0.0017823146 0.0206043827
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15 0.0264916158 0.3062097903
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16 0.0425484993 -0.0036791443
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18 0.0378926850 -0.0032737513
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19 -0.0239067269 0.0020641612
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20 -0.1437223666 0.0124297338
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orbital 1 18 83 3.8294144753 1.0000000000
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1 0.0663988192 0.0085484644
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2 0.1260295954 0.0162304061
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3 -0.0647615080 -0.0083395907
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4 -0.1642264840 -0.0211466278
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5 0.1314648764 0.0169293534
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6 0.0082790579 -0.0643165494
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7 0.0335450043 -0.2606218641
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8 -0.0142557719 0.1107746315
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9 -0.0108043536 0.0839738329
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10 -0.0543439042 0.4222203054
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11 -0.0011041850 0.0085702827
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12 -0.0261233273 0.2029548313
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13 -0.0266238720 0.2068406202
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14 0.0326779879 -0.2538801814
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18 -0.1237889924 -0.0159377432
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19 0.2396673950 0.0308513463
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20 -0.1333758379 -0.0171781924
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orbital 1 18 84 3.8487708158 1.0000000000
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1 -0.0073921693 -0.0274470056
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2 -0.0758528843 -0.2815636261
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3 0.0524666938 0.1947589227
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4 0.0692369298 0.2570076445
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5 -0.0859373867 -0.3189969306
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6 0.0939923078 -0.0253260000
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7 0.1396911821 -0.0376396526
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10 -0.1859918565 0.0501159622
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11 0.0280872956 -0.0075659688
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12 -0.1008040740 0.0271627434
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13 -0.0678324950 0.0182774951
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20 0.0823513499 0.3056946549
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orbital 1 18 85 4.5075946121 0.9998793942
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1 -0.0325518680 -0.4130052379
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2 -0.0044994723 -0.0571294090
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3 -0.0221826736 -0.2814722109
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4 -0.0002806568 -0.0035468223
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8 -0.2362547116 0.0185903867
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9 0.0246007023 -0.0019302918
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17 0.0017487033 0.0222229113
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20 -0.0023770549 -0.0301393207
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1 -0.0918957656 -0.2716167863
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4 -0.0077211282 -0.0228210630
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5 -0.0025220087 -0.0074325784
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6 0.3800713527 -0.1285298518
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7 0.0465076958 -0.0157288503
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8 0.2765215798 -0.0935078452
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9 -0.0920846498 0.0311451239
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10 0.0391945727 -0.0132531540
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19 -0.0011312788 -0.0033322069
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20 -0.0112730468 -0.0333440488
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orbital 1 18 87 4.8439657086 -0.0394218418
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