mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-11-14 18:13:51 +01:00
471 lines
19 KiB
Plaintext
471 lines
19 KiB
Plaintext
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HAFNIUM
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S 7
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1 29.2650000 0.0294330
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2 18.3491000 -0.1987340
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3 11.5257000 0.4359330
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4 4.3859900 -0.7730970
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5 0.8910800 0.8677580
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6 0.4057400 0.4202920
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7 0.0950670 0.0131930
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S 7
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1 29.2650000 -0.0090770
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2 18.3491000 0.0611920
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3 11.5257000 -0.1354740
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4 4.3859900 0.2530470
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5 0.8910800 -0.3699320
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6 0.4057400 -0.3314430
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7 0.0950670 0.6577990
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S 7
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1 29.2650000 0.0309420
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2 18.3491000 -0.1631770
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3 11.5257000 0.3100050
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4 4.3859900 -0.5289420
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5 0.8910800 1.2562440
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6 0.4057400 -0.4970260
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7 0.0950670 -1.8102840
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S 1
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1 0.0358680 1.0000000
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P 6
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1 7.1199600 0.1786130
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2 4.6018200 -0.5085500
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3 2.9004600 0.1812060
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4 0.9377910 0.6364370
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5 0.3915000 0.4348840
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6 0.1071520 0.0442170
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P 6
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1 7.1199600 -0.0485910
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2 4.6018200 0.1398590
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3 2.9004600 -0.0462230
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4 0.9377910 -0.2282940
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5 0.3915000 -0.1575630
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6 0.1071520 0.5288190
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P 6
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1 7.1199600 -0.0658780
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2 4.6018200 0.1871460
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3 2.9004600 -0.0488380
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4 0.9377910 -0.3615180
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5 0.3915000 -0.1743340
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6 0.1071520 0.9190410
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P 1
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1 0.0367710 1.0000000
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D 5
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1 7.4982700 0.0144910
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2 4.6961800 -0.0529680
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3 1.0636000 0.2380440
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4 0.4188210 0.4352750
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5 0.1545660 0.4244200
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D 5
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1 7.4982700 -0.0165460
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2 4.6961800 0.0618730
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3 1.0636000 -0.3167410
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4 0.4188210 -0.5274120
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5 0.1545660 0.3428660
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D 1
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1 0.0526440 1.0000000
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F 1
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1 0.2700000 1.0000000
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TANTALUM
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S 7
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1 29.8670000 0.0287250
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2 18.7203000 -0.1985810
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3 11.7533000 0.4482880
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4 4.5708900 -0.7983960
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5 0.9478400 0.8861040
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6 0.4340380 0.4136940
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7 0.1050310 0.0121460
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S 7
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1 29.8670000 -0.0091320
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2 18.7203000 0.0630170
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3 11.7533000 -0.1437480
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4 4.5708900 0.2705360
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5 0.9478400 -0.4015970
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6 0.4340380 -0.3195670
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7 0.1050310 0.6651050
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S 7
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1 29.8670000 0.0324720
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2 18.7203000 -0.1723550
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3 11.7533000 0.3341840
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4 4.5708900 -0.5725580
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5 0.9478400 1.3652610
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6 0.4340380 -0.6032250
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7 0.1050310 -1.7315730
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S 1
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1 0.0389480 1.0000000
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P 6
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1 7.3652400 0.1796820
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2 4.7544000 -0.5211000
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3 2.9959500 0.1911040
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4 0.9941230 0.6464550
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5 0.4196000 0.4240400
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6 0.1182390 0.0425600
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P 6
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1 7.3652400 -0.0508780
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2 4.7544000 0.1495500
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3 2.9959500 -0.0507540
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4 0.9941230 -0.2483790
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5 0.4196000 -0.1478010
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6 0.1182390 0.5415390
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P 6
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1 7.3652400 -0.0697670
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2 4.7544000 0.2016550
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3 2.9959500 -0.0482900
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4 0.9941230 -0.4247200
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5 0.4196000 -0.1275720
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6 0.1182390 0.9415430
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P 1
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1 0.0401010 1.0000000
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D 5
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1 7.5616000 0.0178690
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2 4.7408700 -0.0661360
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3 1.1697500 0.2554580
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4 0.4793100 0.4454920
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5 0.1837040 0.4029670
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D 5
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1 7.5616000 -0.0205840
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2 4.7408700 0.0780240
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3 1.1697500 -0.3544000
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4 0.4793100 -0.5155940
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5 0.1837040 0.4207610
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D 1
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1 0.0644090 1.0000000
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F 1
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1 0.3735000 1.0000000
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TUNGSTEN
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S 7
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1 31.1844000 0.0268990
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2 19.5385000 -0.1892380
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3 12.2602000 0.4339650
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4 4.7203700 -0.8043720
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5 1.0095700 0.9015400
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6 0.4634560 0.4101950
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7 0.1137920 0.0110440
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S 7
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1 31.1844000 -0.0086330
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2 19.5385000 0.0609770
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3 12.2602000 -0.1418640
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4 4.7203700 0.2797320
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5 1.0095700 -0.4285050
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6 0.4634560 -0.3050150
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7 0.1137920 0.6713040
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S 7
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1 31.1844000 0.0314780
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2 19.5385000 -0.1676990
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3 12.2602000 0.3282920
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4 4.7203700 -0.5865250
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5 1.0095700 1.4154490
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6 0.4634560 -0.6488270
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7 0.1137920 -1.6892530
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S 1
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1 0.0416420 1.0000000
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P 6
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1 7.7873800 0.1852090
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2 5.0493000 -0.5283120
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3 3.1860200 0.1871580
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4 1.0593700 0.6560130
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5 0.4491060 0.4179250
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6 0.1276250 0.0409650
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P 6
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1 7.7873800 -0.0535080
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2 5.0493000 0.1546790
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3 3.1860200 -0.0504270
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4 1.0593700 -0.2604500
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5 0.4491060 -0.1384050
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6 0.1276250 0.5459010
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P 6
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1 7.7873800 -0.0749390
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2 5.0493000 0.2120220
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3 3.1860200 -0.0424460
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4 1.0593700 -0.4793750
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5 0.4491060 -0.0766750
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6 0.1276250 0.9477960
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P 1
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1 0.0427440 1.0000000
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D 5
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1 8.3098300 0.0219490
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2 5.2246300 -0.0773760
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3 1.2952900 0.2632410
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4 0.5397610 0.4595460
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5 0.2089270 0.3922120
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D 5
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1 8.3098300 -0.0263810
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2 5.2246300 0.0952520
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3 1.2952900 -0.3960520
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4 0.5397610 -0.5079960
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5 0.2089270 0.5236000
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D 1
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1 0.0731130 1.0000000
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F 1
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1 0.4769000 1.0000000
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RHENIUM
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S 7
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1 33.0133000 0.0221330
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2 20.6658000 -0.1618310
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3 12.9498000 0.3812300
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4 4.7782300 -0.7875220
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5 1.0858000 0.8980810
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6 0.5000250 0.4224690
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7 0.1210690 0.0172060
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S 7
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1 33.0133000 -0.0070680
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2 20.6658000 0.0530520
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3 12.9498000 -0.1282310
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4 4.7782300 0.2853960
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5 1.0858000 -0.4487810
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6 0.5000250 -0.2976680
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7 0.1210690 0.6634730
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S 7
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1 33.0133000 0.0274240
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2 20.6658000 -0.1468310
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3 12.9498000 0.2908580
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4 4.7782300 -0.5801000
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5 1.0858000 1.4204980
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6 0.5000250 -0.6321790
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7 0.1210690 -1.6875030
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S 1
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1 0.0438810 1.0000000
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P 6
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1 8.6759800 0.1394900
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2 5.6538200 -0.3569770
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3 1.4063900 0.4818040
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4 0.6920560 0.5117960
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5 0.3163520 0.1708180
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6 0.1093090 0.0097820
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P 6
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1 8.6759800 -0.0412390
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2 5.6538200 0.1083450
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3 1.4063900 -0.1688840
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4 0.6920560 -0.2386860
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5 0.3163520 0.0632430
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6 0.1093090 0.6102210
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P 6
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1 8.6759800 -0.0651350
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2 5.6538200 0.1725300
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3 1.4063900 -0.2649320
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4 0.6920560 -0.4743410
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5 0.3163520 0.3991830
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6 0.1093090 0.8030920
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P 1
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1 0.0385810 1.0000000
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D 5
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1 8.6719700 0.0171910
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2 5.4414200 -0.0665390
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3 1.3750800 0.2711570
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4 0.5838300 0.4487710
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5 0.2293620 0.3778590
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D 5
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1 8.6719700 -0.0203340
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2 5.4414200 0.0775390
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3 1.3750800 -0.3686920
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4 0.5838300 -0.4745880
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5 0.2293620 0.4599950
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D 1
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1 0.0808850 1.0000000
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F 1
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1 0.5533000 1.0000000
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OSMIUM
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S 7
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1 34.5933000 0.0194050
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2 21.6442000 -0.1468750
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3 13.5521000 0.3551890
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4 4.8950800 -0.7883690
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5 1.1634600 0.9033000
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6 0.5380840 0.4302560
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7 0.1306730 0.0181640
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S 7
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1 34.5933000 -0.0059240
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2 21.6442000 0.0475810
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3 13.5521000 -0.1198590
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4 4.8950800 0.2905900
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5 1.1634600 -0.4633260
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6 0.5380840 -0.2910580
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7 0.1306730 0.6489970
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S 7
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1 34.5933000 0.0286790
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2 21.6442000 -0.1533520
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3 13.5521000 0.3066570
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4 4.8950800 -0.6590400
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5 1.1634600 1.6880660
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6 0.5380840 -0.9098660
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7 0.1306730 -1.5178370
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S 1
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1 0.0469820 1.0000000
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P 6
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1 9.1259400 0.1316100
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2 5.8907300 -0.3487910
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3 1.4397800 0.5276330
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4 0.6929760 0.5000040
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5 0.3084380 0.1387070
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6 0.1086800 0.0055910
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P 6
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1 9.1259400 -0.0379630
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2 5.8907300 0.1036120
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3 1.4397800 -0.1857190
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4 0.6929760 -0.2213770
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5 0.3084380 0.0960590
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|
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6 0.1086800 0.6029380
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P 6
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1 9.1259400 -0.0676070
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2 5.8907300 0.1858450
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3 1.4397800 -0.3480470
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4 0.6929760 -0.4511480
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5 0.3084380 0.5586130
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6 0.1086800 0.7068530
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P 1
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1 0.0381830 1.0000000
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D 5
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1 9.3395000 0.0158420
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2 5.8557100 -0.0635100
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3 1.4647600 0.2828700
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4 0.6312200 0.4507810
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5 0.2506620 0.3664550
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D 5
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1 9.3395000 -0.0209240
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2 5.8557100 0.0807150
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3 1.4647600 -0.4242800
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4 0.6312200 -0.4620180
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5 0.2506620 0.5555660
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D 1
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1 0.0891640 1.0000000
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F 1
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1 0.6278000 1.0000000
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IRIDIUM
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S 7
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1 36.0577000 0.0172890
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2 22.5516000 -0.1359910
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3 14.1116000 0.3386690
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4 5.0447500 -0.7941690
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5 1.2441700 0.9080010
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6 0.5769240 0.4378070
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7 0.1394660 0.0187690
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S 7
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1 36.0577000 -0.0049480
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2 22.5516000 0.0431240
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3 14.1116000 -0.1138030
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4 5.0447500 0.2953180
|
||
|
|
5 1.2441700 -0.4732180
|
||
|
|
6 0.5769240 -0.2840000
|
||
|
|
7 0.1394660 0.6351880
|
||
|
|
S 7
|
||
|
|
1 36.0577000 0.0290550
|
||
|
|
2 22.5516000 -0.1546790
|
||
|
|
3 14.1116000 0.3116730
|
||
|
|
4 5.0447500 -0.7039290
|
||
|
|
5 1.2441700 1.8161160
|
||
|
|
6 0.5769240 -1.0291110
|
||
|
|
7 0.1394660 -1.4393180
|
||
|
|
S 1
|
||
|
|
1 0.0497400 1.0000000
|
||
|
|
P 6
|
||
|
|
1 9.5858000 0.1256510
|
||
|
|
2 6.1408800 -0.3433060
|
||
|
|
3 1.4976000 0.5536780
|
||
|
|
4 0.7141440 0.4910420
|
||
|
|
5 0.3120660 0.1228370
|
||
|
|
6 0.1151600 0.0033780
|
||
|
|
P 6
|
||
|
|
1 9.5858000 -0.0379390
|
||
|
|
2 6.1408800 0.1069870
|
||
|
|
3 1.4976000 -0.2083670
|
||
|
|
4 0.7141440 -0.2217720
|
||
|
|
5 0.3120660 0.1266520
|
||
|
|
6 0.1151600 0.6103680
|
||
|
|
P 6
|
||
|
|
1 9.5858000 -0.0740030
|
||
|
|
2 6.1408800 0.2101790
|
||
|
|
3 1.4976000 -0.4612670
|
||
|
|
4 0.7141440 -0.3768670
|
||
|
|
5 0.3120660 0.6521120
|
||
|
|
6 0.1151600 0.6073860
|
||
|
|
P 1
|
||
|
|
1 0.0412770 1.0000000
|
||
|
|
D 5
|
||
|
|
1 9.9606900 0.0154630
|
||
|
|
2 6.2430300 -0.0631200
|
||
|
|
3 1.5631700 0.2923090
|
||
|
|
4 0.6819400 0.4527480
|
||
|
|
5 0.2734460 0.3571590
|
||
|
|
D 5
|
||
|
|
1 9.9606900 -0.0198010
|
||
|
|
2 6.2430300 0.0777020
|
||
|
|
3 1.5631700 -0.4252400
|
||
|
|
4 0.6819400 -0.4331870
|
||
|
|
5 0.2734460 0.4752470
|
||
|
|
D 1
|
||
|
|
1 0.0980080 1.0000000
|
||
|
|
F 1
|
||
|
|
1 0.7127000 1.0000000
|
||
|
|
|
||
|
|
PLATINUM
|
||
|
|
S 7
|
||
|
|
1 37.3750000 0.0156980
|
||
|
|
2 23.3685000 -0.1285150
|
||
|
|
3 14.6164000 0.3299960
|
||
|
|
4 5.2209620 -0.8039770
|
||
|
|
5 1.3267320 0.9127650
|
||
|
|
6 0.6163210 0.4444260
|
||
|
|
7 0.1480680 0.0192250
|
||
|
|
S 7
|
||
|
|
1 37.3750000 -0.0041400
|
||
|
|
2 23.3685000 0.0396870
|
||
|
|
3 14.6164000 -0.1100630
|
||
|
|
4 5.2209620 0.3003960
|
||
|
|
5 1.3267320 -0.4809750
|
||
|
|
6 0.6163210 -0.2769970
|
||
|
|
7 0.1480680 0.6216130
|
||
|
|
S 7
|
||
|
|
1 37.3750000 0.0303040
|
||
|
|
2 23.3685000 -0.1595530
|
||
|
|
3 14.6164000 0.3222870
|
||
|
|
4 5.2209620 -0.7469090
|
||
|
|
5 1.3267320 1.9183060
|
||
|
|
6 0.6163210 -1.1164460
|
||
|
|
7 0.1480680 -1.3836520
|
||
|
|
S 1
|
||
|
|
1 0.0523910 1.0000000
|
||
|
|
P 6
|
||
|
|
1 9.9926800 0.1240460
|
||
|
|
2 6.3831700 -0.3446320
|
||
|
|
3 1.5696500 0.5711200
|
||
|
|
4 0.7427790 0.4873560
|
||
|
|
5 0.3180200 0.1119590
|
||
|
|
6 0.1141460 0.0019280
|
||
|
|
P 6
|
||
|
|
1 9.9926800 -0.0346870
|
||
|
|
2 6.3831700 0.0999320
|
||
|
|
3 1.5696500 -0.2018840
|
||
|
|
4 0.7427790 -0.1984590
|
||
|
|
5 0.3180200 0.1230340
|
||
|
|
6 0.1141460 0.5955770
|
||
|
|
P 6
|
||
|
|
1 9.9926800 -0.0771530
|
||
|
|
2 6.3831700 0.2234940
|
||
|
|
3 1.5696500 -0.5228040
|
||
|
|
4 0.7427790 -0.3298980
|
||
|
|
5 0.3180200 0.7297730
|
||
|
|
6 0.1141460 0.5372880
|
||
|
|
P 1
|
||
|
|
1 0.0398630 1.0000000
|
||
|
|
D 5
|
||
|
|
1 10.4126000 0.0150800
|
||
|
|
2 6.5226600 -0.0622950
|
||
|
|
3 1.6643000 0.3006490
|
||
|
|
4 0.7342080 0.4539610
|
||
|
|
5 0.2974070 0.3490010
|
||
|
|
D 5
|
||
|
|
1 10.4126000 -0.0198660
|
||
|
|
2 6.5226600 0.0796630
|
||
|
|
3 1.6643000 -0.4687940
|
||
|
|
4 0.7342080 -0.4051740
|
||
|
|
5 0.2974070 0.5192890
|
||
|
|
D 1
|
||
|
|
1 0.1075990 1.0000000
|
||
|
|
F 1
|
||
|
|
1 0.8018000 1.0000000
|
||
|
|
|
||
|
|
|