mirror of
https://github.com/pfloos/quack
synced 2024-11-05 13:43:51 +01:00
836 lines
30 KiB
Plaintext
836 lines
30 KiB
Plaintext
ALUMINUM
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S 16
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2 546800.0000000 0.0000145
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3 124500.0000000 0.0000762
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6 4434.0000000 0.0033697
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7 1812.0000000 0.0093222
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8 791.5000000 0.0237992
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9 361.0000000 0.0568191
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10 169.5000000 0.1224680
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11 81.6800000 0.2238970
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12 40.2800000 0.3134460
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16 2.3390000 0.0006528
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S 16
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3 124500.0000000 -0.0000198
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4 35440.0000000 -0.0000821
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S 16
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2 546800.0000000 0.0000009
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3 124500.0000000 0.0000046
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11 81.6800000 0.0165276
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13 20.2500000 0.0361484
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16 2.3390000 -0.1512630
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S 1
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1 1.1630000 1.0000000
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S 1
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S 1
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S 1
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S 1
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S 1
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P 9
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5 35.8100000 0.0433403
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6 16.2200000 0.1119500
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8 3.7410000 0.3116750
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9 1.8310000 0.3167220
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P 9
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3 222.0000000 -0.0003999
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4 84.8200000 -0.0015369
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5 35.8100000 -0.0055644
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6 16.2200000 -0.0131106
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7 7.7020000 -0.0297200
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8 3.7410000 -0.0347195
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9 1.8310000 -0.0551621
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P 1
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1 0.8878000 1.0000000
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P 1
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P 1
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P 1
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1 0.0729800 1.0000000
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P 1
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P 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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F 1
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F 1
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F 1
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F 1
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F 1
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G 1
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G 1
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G 1
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G 1
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H 1
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H 1
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H 1
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I 1
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I 1
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SILICON
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S 16
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1 4465000.0000000 0.0000017
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2 668500.0000000 0.0000136
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3 152200.0000000 0.0000714
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6 5394.0000000 0.0031747
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7 2212.0000000 0.0087324
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8 968.1000000 0.0223830
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9 441.2000000 0.0537273
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10 207.1000000 0.1166490
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11 99.8000000 0.2159780
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15 5.7950000 0.0141952
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16 2.8300000 0.0003121
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S 16
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1 4465000.0000000 -0.0000005
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2 668500.0000000 -0.0000036
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3 152200.0000000 -0.0000190
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4 43300.0000000 -0.0000791
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5 14410.0000000 -0.0002769
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6 5394.0000000 -0.0008472
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7 2212.0000000 -0.0023478
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8 968.1000000 -0.0060705
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9 441.2000000 -0.0149711
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10 207.1000000 -0.0339729
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11 99.8000000 -0.0694584
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12 49.2400000 -0.1190010
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13 24.7400000 -0.1536450
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14 12.4700000 -0.0704684
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15 5.7950000 0.2131490
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16 2.8300000 0.4915960
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S 16
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1 4465000.0000000 0.0000001
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2 668500.0000000 0.0000009
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3 152200.0000000 0.0000049
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4 43300.0000000 0.0000203
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5 14410.0000000 0.0000709
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6 5394.0000000 0.0002172
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7 2212.0000000 0.0006013
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8 968.1000000 0.0015591
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9 441.2000000 0.0038443
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10 207.1000000 0.0087797
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11 99.8000000 0.0180388
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12 49.2400000 0.0315224
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13 24.7400000 0.0416905
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14 12.4700000 0.0200973
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15 5.7950000 -0.0667484
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16 2.8300000 -0.1819060
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S 1
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1 1.4070000 1.0000000
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S 1
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1 0.6995000 1.0000000
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S 1
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1 0.3083000 1.0000000
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S 1
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1 0.1385000 1.0000000
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S 1
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1 0.0614500 1.0000000
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S 1
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1 0.0253900 1.0000000
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P 9
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1 3572.0000000 0.0000599
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2 846.0000000 0.0005296
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3 274.8000000 0.0029958
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4 105.0000000 0.0126335
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5 44.3500000 0.0419044
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6 20.0800000 0.1102590
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7 9.5300000 0.2188310
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8 4.6340000 0.3178280
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9 2.2800000 0.3194250
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P 9
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1 3572.0000000 -0.0000128
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2 846.0000000 -0.0001126
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3 274.8000000 -0.0006402
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4 105.0000000 -0.0027029
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5 44.3500000 -0.0090789
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7 9.5300000 -0.0493460
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8 4.6340000 -0.0725859
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9 2.2800000 -0.0804258
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P 1
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1 1.1160000 1.0000000
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P 1
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1 0.4991000 1.0000000
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P 1
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1 0.2254000 1.0000000
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P 1
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1 0.1001000 1.0000000
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P 1
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1 0.0433200 1.0000000
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P 1
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1 0.0169400 1.0000000
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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F 1
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F 1
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F 1
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F 1
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F 1
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G 1
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G 1
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G 1
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G 1
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H 1
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H 1
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H 1
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I 1
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I 1
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PHOSPHORUS
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S 16
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2 806200.0000000 0.0000128
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3 183600.0000000 0.0000672
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S 16
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S 16
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2 806200.0000000 0.0000010
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3 183600.0000000 0.0000050
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4 52250.0000000 0.0000209
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5 17390.0000000 0.0000730
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6 6523.0000000 0.0002221
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7 2687.0000000 0.0006122
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8 1178.0000000 0.0015918
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S 1
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S 1
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S 1
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S 1
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S 1
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S 1
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P 9
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5 56.5200000 0.0378229
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8 5.9020000 0.3173830
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P 9
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1 4552.0000000 -0.0000124
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P 1
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P 1
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P 1
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P 1
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P 1
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D 1
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G 1
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G 1
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G 1
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G 1
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H 1
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I 1
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SULFUR
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S 16
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P 9
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P 9
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P 1
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P 1
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P 1
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D 1
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D 1
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1 0.3800000 1.0000000
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D 1
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1 0.1600000 1.0000000
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D 1
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1 0.0609000 1.0000000
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F 1
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1 2.2120000 1.0000000
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F 1
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1 1.0630000 1.0000000
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F 1
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1 0.5100000 1.0000000
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F 1
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1 0.2450000 1.0000000
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F 1
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1 0.1100000 1.0000000
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G 1
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1 1.3473000 1.0000000
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G 1
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1 0.7009000 1.0000000
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G 1
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1 0.3647000 1.0000000
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G 1
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1 0.1799000 1.0000000
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H 1
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1 1.2861000 1.0000000
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H 1
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1 0.6115000 1.0000000
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H 1
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1 0.3465000 1.0000000
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I 1
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1 1.0409000 1.0000000
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I 1
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1 0.6222000 1.0000000
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|
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CHLORINE
|
|
S 16
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|
1 7733000.0000000 0.14347400E-05
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2 1158000.0000000 0.11148600E-04
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|
3 263700.0000000 0.58586500E-04
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4 75010.0000000 0.24451800E-03
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5 24890.0000000 0.85828700E-03
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6 9318.0000000 0.26101900E-02
|
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7 3840.0000000 0.71378400E-02
|
|
8 1684.0000000 0.18456400E-01
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|
9 766.3000000 0.44894400E-01
|
|
10 359.5000000 0.99382200E-01
|
|
11 173.4000000 0.19078200
|
|
12 85.6100000 0.29356500
|
|
13 42.9300000 0.30647700
|
|
14 21.5500000 0.16220900
|
|
15 10.0500000 0.24938300E-01
|
|
16 4.9780000 -0.51314200E-03
|
|
S 16
|
|
1 7733000.0000000 -0.40222700E-06
|
|
2 1158000.0000000 -0.31244800E-05
|
|
3 263700.0000000 -0.16429000E-04
|
|
4 75010.0000000 -0.68542100E-04
|
|
5 24890.0000000 -0.24100100E-03
|
|
6 9318.0000000 -0.73353800E-03
|
|
7 3840.0000000 -0.20183000E-02
|
|
8 1684.0000000 -0.52610700E-02
|
|
9 766.3000000 -0.13098600E-01
|
|
10 359.5000000 -0.30179400E-01
|
|
11 173.4000000 -0.63188800E-01
|
|
12 85.6100000 -0.11385900
|
|
13 42.9300000 -0.16125100
|
|
14 21.5500000 -0.10923400
|
|
15 10.0500000 0.16299900
|
|
16 4.9780000 0.50141300
|
|
S 16
|
|
1 7733000.0000000 0.12169600E-06
|
|
2 1158000.0000000 0.94514100E-06
|
|
3 263700.0000000 0.49711900E-05
|
|
4 75010.0000000 0.20732300E-04
|
|
5 24890.0000000 0.72940200E-04
|
|
6 9318.0000000 0.22189900E-03
|
|
7 3840.0000000 0.61135500E-03
|
|
8 1684.0000000 0.15933700E-02
|
|
9 766.3000000 0.39800100E-02
|
|
10 359.5000000 0.91937500E-02
|
|
11 173.4000000 0.19439900E-01
|
|
12 85.6100000 0.35518700E-01
|
|
13 42.9300000 0.52067400E-01
|
|
14 21.5500000 0.36564400E-01
|
|
15 10.0500000 -0.59750000E-01
|
|
16 4.9780000 -0.23164100
|
|
S 1
|
|
1 2.4780000 1.0000000
|
|
S 1
|
|
1 1.1800000 1.0000000
|
|
S 1
|
|
1 0.5828000 1.0000000
|
|
S 1
|
|
1 0.2668000 1.0000000
|
|
S 1
|
|
1 0.1183000 1.0000000
|
|
S 1
|
|
1 0.0462500 1.0000000
|
|
P 9
|
|
1 6091.0000000 0.51619400E-04
|
|
2 1442.0000000 0.45846800E-03
|
|
3 468.3000000 0.26150900E-02
|
|
4 179.0000000 0.11255400E-01
|
|
5 75.6100000 0.38457700E-01
|
|
6 34.2200000 0.10508100E+00
|
|
7 16.2300000 0.21860300E+00
|
|
8 7.8900000 0.33087400E+00
|
|
9 3.8980000 0.32587900E+00
|
|
P 9
|
|
1 6091.0000000 -0.13925900E-04
|
|
2 1442.0000000 -0.12332400E-03
|
|
3 468.3000000 -0.70755100E-03
|
|
4 179.0000000 -0.30493900E-02
|
|
5 75.6100000 -0.10575200E-01
|
|
6 34.2200000 -0.29409400E-01
|
|
7 16.2300000 -0.63229600E-01
|
|
8 7.8900000 -0.98187000E-01
|
|
9 3.8980000 -0.10587000E+00
|
|
P 1
|
|
1 1.9330000 1.0000000
|
|
P 1
|
|
1 0.9057000 1.0000000
|
|
P 1
|
|
1 0.4140000 1.0000000
|
|
P 1
|
|
1 0.1836000 1.0000000
|
|
P 1
|
|
1 0.0785900 1.0000000
|
|
P 1
|
|
1 0.0316300 1.0000000
|
|
D 1
|
|
1 14.7720000 1.0000000
|
|
D 1
|
|
1 3.8200000 1.0000000
|
|
D 1
|
|
1 1.5830000 1.0000000
|
|
D 1
|
|
1 1.0360000 1.0000000
|
|
D 1
|
|
1 0.4880000 1.0000000
|
|
D 1
|
|
1 0.2030000 1.0000000
|
|
D 1
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|
1 0.0775000 1.0000000
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F 1
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|
1 2.5327000 1.0000000
|
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F 1
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1 1.2406000 1.0000000
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F 1
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1 0.6077000 1.0000000
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F 1
|
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1 0.2977000 1.0000000
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F 1
|
|
1 0.1465000 1.0000000
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G 1
|
|
1 1.5388000 1.0000000
|
|
G 1
|
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1 0.8050000 1.0000000
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G 1
|
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1 0.4212000 1.0000000
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G 1
|
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1 0.2177000 1.0000000
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H 1
|
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1 1.5613000 1.0000000
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H 1
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1 0.7397000 1.0000000
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H 1
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1 0.4365000 1.0000000
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I 1
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1 1.2572000 1.0000000
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I 1
|
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1 0.8074000 1.0000000
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|
|
|
ARGON
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|
S 16
|
|
1 9149000.0000000 0.0000013
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|
2 1370000.0000000 0.0000104
|
|
3 311900.0000000 0.0000549
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4 88650.0000000 0.0002296
|
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5 29330.0000000 0.0008103
|
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6 10930.0000000 0.0024853
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7 4480.0000000 0.0068369
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|
8 1962.0000000 0.0176199
|
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9 894.1000000 0.0428752
|
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10 419.6000000 0.0954853
|
|
11 202.3000000 0.1850640
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12 99.8400000 0.2890420
|
|
13 50.0700000 0.3101660
|
|
14 25.1400000 0.1721830
|
|
15 11.8100000 0.0285227
|
|
16 5.8820000 -0.0005757
|
|
S 16
|
|
1 9149000.0000000 -0.0000004
|
|
2 1370000.0000000 -0.0000030
|
|
3 311900.0000000 -0.0000156
|
|
4 88650.0000000 -0.0000652
|
|
5 29330.0000000 -0.0002304
|
|
6 10930.0000000 -0.0007075
|
|
7 4480.0000000 -0.0019573
|
|
8 1962.0000000 -0.0050856
|
|
9 894.1000000 -0.0126528
|
|
10 419.6000000 -0.0293065
|
|
11 202.3000000 -0.0617712
|
|
12 99.8400000 -0.1125410
|
|
13 50.0700000 -0.1622930
|
|
14 25.1400000 -0.1184120
|
|
15 11.8100000 0.1461480
|
|
16 5.8820000 0.4977520
|
|
S 16
|
|
1 9149000.0000000 0.0000001
|
|
2 1370000.0000000 0.0000009
|
|
3 311900.0000000 0.0000049
|
|
4 88650.0000000 0.0000204
|
|
5 29330.0000000 0.0000720
|
|
6 10930.0000000 0.0002210
|
|
7 4480.0000000 0.0006125
|
|
8 1962.0000000 0.0015908
|
|
9 894.1000000 0.0039722
|
|
10 419.6000000 0.0092204
|
|
11 202.3000000 0.0196367
|
|
12 99.8400000 0.0362570
|
|
13 50.0700000 0.0541725
|
|
14 25.1400000 0.0409996
|
|
15 11.8100000 -0.0551744
|
|
16 5.8820000 -0.2387540
|
|
S 1
|
|
1 2.9390000 1.0000000
|
|
S 1
|
|
1 1.4050000 1.0000000
|
|
S 1
|
|
1 0.6963000 1.0000000
|
|
S 1
|
|
1 0.3188000 1.0000000
|
|
S 1
|
|
1 0.1410000 1.0000000
|
|
S 1
|
|
1 0.0535700 1.0000000
|
|
P 9
|
|
1 7050.0000000 0.0000502
|
|
2 1669.0000000 0.0004454
|
|
3 542.1000000 0.0025480
|
|
4 207.1000000 0.0110155
|
|
5 87.5200000 0.0378490
|
|
6 39.6100000 0.1043550
|
|
7 18.7800000 0.2193350
|
|
8 9.1300000 0.3346150
|
|
9 4.5160000 0.3267710
|
|
P 9
|
|
1 7050.0000000 -0.0000140
|
|
2 1669.0000000 -0.0001243
|
|
3 542.1000000 -0.0007147
|
|
4 207.1000000 -0.0030968
|
|
5 87.5200000 -0.0107961
|
|
6 39.6100000 -0.0303536
|
|
7 18.7800000 -0.0659785
|
|
8 9.1300000 -0.1038770
|
|
9 4.5160000 -0.1099560
|
|
P 1
|
|
1 2.2450000 1.0000000
|
|
P 1
|
|
1 1.0650000 1.0000000
|
|
P 1
|
|
1 0.4885000 1.0000000
|
|
P 1
|
|
1 0.2166000 1.0000000
|
|
P 1
|
|
1 0.0925500 1.0000000
|
|
P 1
|
|
1 0.0367800 1.0000000
|
|
D 1
|
|
1 17.7430000 1.0000000
|
|
D 1
|
|
1 4.5800000 1.0000000
|
|
D 1
|
|
1 1.8890000 1.0000000
|
|
D 1
|
|
1 1.2520000 1.0000000
|
|
D 1
|
|
1 0.5940000 1.0000000
|
|
D 1
|
|
1 0.2470000 1.0000000
|
|
D 1
|
|
1 0.0898000 1.0000000
|
|
F 1
|
|
1 3.0582000 1.0000000
|
|
F 1
|
|
1 1.5292000 1.0000000
|
|
F 1
|
|
1 0.7647000 1.0000000
|
|
F 1
|
|
1 0.3824000 1.0000000
|
|
F 1
|
|
1 0.1830000 1.0000000
|
|
G 1
|
|
1 1.8450000 1.0000000
|
|
G 1
|
|
1 0.9657000 1.0000000
|
|
G 1
|
|
1 0.5055000 1.0000000
|
|
G 1
|
|
1 0.2555000 1.0000000
|
|
H 1
|
|
1 1.8743000 1.0000000
|
|
H 1
|
|
1 0.8871000 1.0000000
|
|
H 1
|
|
1 0.5265000 1.0000000
|
|
I 1
|
|
1 1.5066000 1.0000000
|
|
I 1
|
|
1 0.9926000 1.0000000
|
|
|
|
|