mirror of
https://github.com/pfloos/quack
synced 2024-12-23 04:43:42 +01:00
3017 lines
99 KiB
Plaintext
3017 lines
99 KiB
Plaintext
HYDROGEN
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S 3
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1 34.87758369 0.0235323
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2 5.23397281 0.1767166
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3 1.18503342 0.7997511
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S 1
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1 0.32833943 1.0000000
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S 1
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1 0.11031918 1.0000000
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P 1
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1 0.7188440 1.0000000
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P 1
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1 0.3500000 1.0000000
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D 1
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1 1.0750600 1.0000000
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HELIUM
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S 3
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1 99.4613399 0.0265561
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2 14.9507524 0.1928164
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3 3.35324515 0.7806275
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S 1
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1 0.89096786 1.0000000
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S 1
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1 0.24892564 1.0000000
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P 1
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1 3.28221999 1.0000000
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P 1
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1 0.7917230 1.0000000
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D 1
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1 1.88911999 1.0000000
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LITHIUM
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S 6
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1 2027.47420535 0.0007295
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2 305.05639184 0.0056130
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3 69.40582864 0.0287880
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4 19.56145563 0.1107808
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5 6.33475716 0.3060095
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6 2.26781382 0.5480791
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S 1
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1 0.89243976 1.0000000
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S 1
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1 0.37919044 1.0000000
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S 1
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1 0.07654042 1.0000000
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S 1
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1 0.02858161 1.0000000
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P 4
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1 6.12819345 0.0101119
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2 1.34557307 0.0571663
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3 0.36143972 0.2336120
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4 0.11777962 0.8035311
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P 1
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1 0.04435100 1.0000000
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P 1
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1 0.01784022 1.0000000
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D 1
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1 0.121468535 1.0000000
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D 1
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1 0.04980293 1.0000000
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F 1
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1 0.05461251 1.0000000
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BERYLLIUM
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S 6
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1 3912.17914788 0.0007613
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2 590.27129139 0.0058332
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3 134.84517744 0.0298485
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4 38.15635575 0.1158401
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5 12.3976811 0.3302261
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6 4.44266338 0.6203736
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S 1
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1 1.75805118 1.0000000
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S 1
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1 0.75189041 1.0000000
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S 1
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1 0.17692111 1.0000000
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S 1
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1 0.06330857 1.0000000
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P 4
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1 13.52944849 0.0104895
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2 3.05170146 0.0648956
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3 0.86972775 0.2619043
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4 0.29380258 0.7713095
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P 1
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1 0.11221497 1.0000000
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P 1
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1 0.04375479 1.0000000
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D 1
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1 0.3926000 1.0000000
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D 1
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1 0.1085183 1.0000000
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F 1
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1 0.2920900 1.0000000
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BORON
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S 6
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1 5171.25825999 0.0008357
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2 778.83149226 0.0064063
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3 178.45473206 0.0323606
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4 50.95595606 0.1222058
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5 16.6676643 0.3380954
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6 5.92018415 0.6071275
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S 1
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1 2.39787337 1.0000000
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S 1
|
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1 1.30416407 1.0000000
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S 1
|
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1 0.2896449 1.0000000
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S 1
|
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1 0.09686921 1.0000000
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P 4
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1 22.07752591 0.0113933
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2 5.01632409 0.0741396
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3 1.47464931 0.2948262
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4 0.50293562 0.7361047
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P 1
|
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1 0.22030809 1.0000000
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P 1
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1 0.08549193 1.0000000
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D 1
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1 0.7077700 1.0000000
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D 1
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1 0.2269140 1.0000000
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F 1
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1 0.5324040 1.0000000
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CARBON
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S 5
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1 7615.05999113 0.0017784
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2 1145.08684615 0.0136680
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3 261.91952431 0.0692908
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4 74.66834196 0.2631529
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5 24.40551202 0.7344482
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S 2
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1 8.68679013 0.5885314
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2 3.23657623 0.4536170
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S 1
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1 1.30179999 1.0000000
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S 1
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1 0.52768873 1.0000000
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S 1
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1 0.15694534 1.0000000
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P 4
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1 34.50767936 0.0114038
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2 7.91304441 0.0765963
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3 2.36615458 0.3029741
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4 0.81172425 0.7264544
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P 1
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1 0.31228882 1.0000000
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P 1
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1 0.11400266 1.0000000
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D 1
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1 1.1540490 1.0000000
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D 1
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1 0.3511286 1.0000000
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F 1
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1 0.8193120 1.0000000
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NITROGEN
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S 5
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1 10259.65669438 0.0017931
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2 1542.36864597 0.0137833
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3 352.92239285 0.0698018
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4 100.80632697 0.2641269
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5 33.10725394 0.7328001
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S 2
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1 11.88253928 0.5913763
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2 4.46790829 0.4499684
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S 1
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1 1.19676433 1.0000000
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S 1
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1 0.63915992 1.0000000
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S 1
|
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1 0.19744232 1.0000000
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P 4
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1 49.11376009 0.0114857
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2 11.32541037 0.0786357
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3 3.42249686 0.3087282
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4 1.1785157 0.7194875
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P 1
|
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1 0.43449114 1.0000000
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P 1
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1 0.15193747 1.0000000
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D 1
|
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1 1.7291770 1.0000000
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D 1
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1 0.5083460 1.0000000
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F 1
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1 1.1635804 1.0000000
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|
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OXYGEN
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S 5
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1 12870.84508387 0.0018613
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2 1952.24777235 0.0140129
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3 454.02969464 0.0696960
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4 130.28372806 0.2644031
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5 42.7927326 0.7323917
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S 2
|
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1 15.44629006 0.5962536
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2 5.87766148 0.4440186
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S 1
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1 1.53426392 1.0000000
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S 1
|
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1 0.81600697 1.0000000
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S 1
|
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1 0.2601108 1.0000000
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P 4
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1 63.35247031 0.0119925
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2 14.66997581 0.0826028
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3 4.46631945 0.3191903
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4 1.53127988 0.7081524
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P 1
|
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1 0.5440053 1.0000000
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P 1
|
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1 0.1799847 1.0000000
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D 1
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1 2.3901600 1.0000000
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D 1
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1 0.6818330 1.0000000
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F 1
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1 1.5109480 1.0000000
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FLUORINE
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S 5
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1 16736.04332217 0.0018033
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2 2517.47266937 0.0138540
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3 575.9521789 0.0702102
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4 164.57735695 0.2653447
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5 54.27385737 0.7310817
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S 2
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1 19.67931067 0.5966610
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2 7.49543072 0.4435267
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S 1
|
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1 1.88568025 1.0000000
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S 1
|
|
1 0.97986789 1.0000000
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S 1
|
|
1 0.32385317 1.0000000
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P 4
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1 80.49602312 0.0122694
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2 18.6539934 0.0854197
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3 5.70273743 0.3260431
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4 1.95547755 0.7002175
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P 1
|
|
1 0.68295355 1.0000000
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|
P 1
|
|
1 0.22044626 1.0000000
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D 1
|
|
1 3.18146999 1.0000000
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D 1
|
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1 0.8903242 1.0000000
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F 1
|
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1 1.99355999 1.0000000
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NEON
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S 5
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1 21250.97587273 0.0017810
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2 3196.05873935 0.0136806
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3 731.88070941 0.0692910
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4 209.23827464 0.2629480
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5 68.88165241 0.7340352
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S 2
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1 24.87591417 0.5932107
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2 9.4238370 0.4474902
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S 1
|
|
1 2.34631312 1.0000000
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|
S 1
|
|
1 1.19871952 1.0000000
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S 1
|
|
1 0.39905375 1.0000000
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P 4
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1 99.44983978 0.0125490
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2 23.1005548 0.0877358
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3 7.09608648 0.3308130
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4 2.4372660 0.6942016
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P 1
|
|
1 0.84289049 1.0000000
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P 1
|
|
1 0.2677861 1.0000000
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D 1
|
|
1 4.0917000 1.0000000
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D 1
|
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1 1.1295300 1.0000000
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F 1
|
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1 2.60614994 1.0000000
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|
SODIUM
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S 5
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1 46910.10147426 0.0015161
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2 7291.75859272 0.0110963
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3 1718.48615212 0.0555093
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4 486.97431849 0.2318621
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5 153.75560971 0.7744116
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S 2
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|
1 2.55257801 0.4229586
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|
2 0.97487933 0.6164537
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S 1
|
|
1 53.40539255 1.0000000
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|
S 1
|
|
1 20.47969926 1.0000000
|
|
S 1
|
|
1 8.21230427 1.0000000
|
|
S 1
|
|
1 0.38623451 1.0000000
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|
S 1
|
|
1 0.06592569 1.0000000
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|
S 1
|
|
1 0.02575331 1.0000000
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P 6
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1 229.39834725 -0.0025691
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2 56.79793674 -0.0175366
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3 19.04910274 -0.0744063
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4 6.96028206 -0.2272533
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5 2.61593085 -0.4157517
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6 0.98316335 -0.4569710
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|
P 1
|
|
1 0.36950907 1.0000000
|
|
P 1
|
|
1 0.13887514 1.0000000
|
|
P 1
|
|
1 0.05219440 1.0000000
|
|
P 1
|
|
1 0.01961658 1.0000000
|
|
D 1
|
|
1 0.1404500 1.0000000
|
|
D 1
|
|
1 0.0300040 1.0000000
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F 1
|
|
1 0.1413500 1.0000000
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|
|
|
MAGNESIUM
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S 5
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1 55205.89651437 0.0017771
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2 8794.40867233 0.0127404
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3 2064.30589033 0.0642417
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4 610.28662223 0.2375529
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5 208.80576404 0.7573511
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S 2
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1 3.17030291 0.4201610
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2 1.20799912 0.6193401
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|
S 1
|
|
1 73.57500419 1.0000000
|
|
S 1
|
|
1 27.15484646 1.0000000
|
|
S 1
|
|
1 10.42300329 1.0000000
|
|
S 1
|
|
1 0.49182585 1.0000000
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|
S 1
|
|
1 0.15228159 1.0000000
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|
S 1
|
|
1 0.05296776 1.0000000
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|
P 6
|
|
1 251.65039296 0.0029924
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2 68.19093282 0.0179628
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3 22.91892841 0.0816165
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4 8.04390837 0.2576142
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5 2.90724837 0.4508870
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6 1.08098933 0.3921255
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P 1
|
|
1 0.40250592 1.0000000
|
|
P 1
|
|
1 0.1871165 1.0000000
|
|
P 1
|
|
1 0.07096954 1.0000000
|
|
P 1
|
|
1 0.02820227 1.0000000
|
|
D 1
|
|
1 0.1940100 1.0000000
|
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D 1
|
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1 0.0643323 1.0000000
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F 1
|
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1 0.1538100 1.0000000
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|
|
|
ALUMINUM
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S 5
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1 57132.22963598 0.0009145
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2 9063.64438492 0.0157339
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3 2263.95575717 0.0595883
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4 692.94898317 0.2382978
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5 231.00443137 0.7597123
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S 2
|
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1 4.03213935 0.3958396
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2 1.64510071 0.6378705
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S 1
|
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1 83.58006097 1.0000000
|
|
S 1
|
|
1 32.02815603 1.0000000
|
|
S 1
|
|
1 12.5667152 1.0000000
|
|
S 1
|
|
1 0.73792944 1.0000000
|
|
S 1
|
|
1 0.21471657 1.0000000
|
|
S 1
|
|
1 0.07346639 1.0000000
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|
P 6
|
|
1 531.61492956 0.0014229
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2 126.26091718 0.0116678
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|
3 39.68444153 0.0587814
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4 14.23986945 0.1978245
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|
5 5.53289991 0.4064100
|
|
6 2.24017199 0.4886646
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|
P 1
|
|
1 0.9296326 1.0000000
|
|
P 1
|
|
1 0.32905366 1.0000000
|
|
P 1
|
|
1 0.12452688 1.0000000
|
|
P 1
|
|
1 0.04497926 1.0000000
|
|
D 1
|
|
1 0.33354002 1.0000000
|
|
D 1
|
|
1 0.1191200 1.0000000
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F 1
|
|
1 0.2799440 1.0000000
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|
|
|
SILICON
|
|
S 5
|
|
1 90425.63194729 0.0015440
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2 13923.4981189 0.0114892
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3 3272.10058588 0.0570526
|
|
4 941.40996064 0.2334038
|
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5 304.95812555 0.7700180
|
|
S 2
|
|
1 5.20046278 0.3486994
|
|
2 2.23311879 0.6798295
|
|
S 1
|
|
1 109.34856241 1.0000000
|
|
S 1
|
|
1 41.38106607 1.0000000
|
|
S 1
|
|
1 15.91806817 1.0000000
|
|
S 1
|
|
1 1.0044599 1.0000000
|
|
S 1
|
|
1 0.29730731 1.0000000
|
|
S 1
|
|
1 0.10188298 1.0000000
|
|
P 6
|
|
1 514.37681176 0.0018844
|
|
2 140.2051930 0.0120681
|
|
3 47.48042551 0.0571845
|
|
4 17.58334578 0.1916339
|
|
5 6.9619908 0.4014596
|
|
6 2.86320541 0.4951609
|
|
P 1
|
|
1 1.20986159 1.0000000
|
|
P 1
|
|
1 0.46011558 1.0000000
|
|
P 1
|
|
1 0.17324322 1.0000000
|
|
P 1
|
|
1 0.0631557 1.0000000
|
|
D 1
|
|
1 0.4605976 1.0000000
|
|
D 1
|
|
1 0.1620190 1.0000000
|
|
F 1
|
|
1 0.3749920 1.0000000
|
|
|
|
PHOSPHORUS
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|
S 5
|
|
1 105893.2073792 0.0016284
|
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2 16320.82641806 0.0119944
|
|
3 3893.86142814 0.0580727
|
|
4 1144.86989448 0.2305152
|
|
5 375.27561109 0.7707008
|
|
S 2
|
|
1 6.21597163 -0.6488846
|
|
2 2.7094359 -0.3780598
|
|
S 1
|
|
1 133.22484399 1.0000000
|
|
S 1
|
|
1 49.70707715 1.0000000
|
|
S 1
|
|
1 19.0165987 1.0000000
|
|
S 1
|
|
1 1.94617654 1.0000000
|
|
S 1
|
|
1 0.36434903 1.0000000
|
|
S 1
|
|
1 0.13790009 1.0000000
|
|
P 6
|
|
1 653.90840732 0.0016951
|
|
2 167.62588955 0.0121472
|
|
3 55.45135875 0.0582630
|
|
4 20.55820884 0.1937807
|
|
5 8.19725119 0.4038282
|
|
6 3.41519163 0.4879686
|
|
P 1
|
|
1 1.47928869 1.0000000
|
|
P 1
|
|
1 0.6028825 1.0000000
|
|
P 1
|
|
1 0.22679656 1.0000000
|
|
P 1
|
|
1 0.08312664 1.0000000
|
|
D 1
|
|
1 0.6183750 1.0000000
|
|
D 1
|
|
1 0.2144150 1.0000000
|
|
F 1
|
|
1 0.4862304 1.0000000
|
|
|
|
SULFUR
|
|
S 5
|
|
1 131334.98114592 0.0016568
|
|
2 20181.90041917 0.0122389
|
|
3 4835.70463137 0.0585215
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|
4 1439.7381539 0.2288037
|
|
5 476.15426264 0.7710923
|
|
S 2
|
|
1 3.37495581 -0.6366236
|
|
2 1.51749916 -0.3903950
|
|
S 1
|
|
1 168.68252004 1.0000000
|
|
S 1
|
|
1 62.92253974 1.0000000
|
|
S 1
|
|
1 24.33329987 1.0000000
|
|
S 1
|
|
1 6.86573753 1.0000000
|
|
S 1
|
|
1 0.44651463 1.0000000
|
|
S 1
|
|
1 0.16174242 1.0000000
|
|
P 6
|
|
1 754.1523594 0.0016843
|
|
2 193.63344693 0.0120611
|
|
3 64.14106193 0.0581962
|
|
4 23.75714449 0.1952336
|
|
5 9.45234322 0.4084056
|
|
6 3.93996824 0.4820176
|
|
P 1
|
|
1 1.72080555 1.0000000
|
|
P 1
|
|
1 0.77076298 1.0000000
|
|
P 1
|
|
1 0.28737379 1.0000000
|
|
P 1
|
|
1 0.1011323 1.0000000
|
|
D 1
|
|
1 0.7813370 1.0000000
|
|
D 1
|
|
1 0.2648390 1.0000000
|
|
F 1
|
|
1 0.5837900 1.0000000
|
|
|
|
CHLORINE
|
|
S 5
|
|
1 181678.82698244 0.0013794
|
|
2 27435.27709666 0.0105598
|
|
3 6322.37997866 0.0540819
|
|
4 1795.44303926 0.2249075
|
|
5 575.0790025 0.7806878
|
|
S 2
|
|
1 4.08968894 -0.6303004
|
|
2 1.84597271 -0.3966380
|
|
S 1
|
|
1 201.17812871 1.0000000
|
|
S 1
|
|
1 74.61037542 1.0000000
|
|
S 1
|
|
1 28.63265512 1.0000000
|
|
S 1
|
|
1 8.23556833 1.0000000
|
|
S 1
|
|
1 0.54888997 1.0000000
|
|
S 1
|
|
1 0.19788882 1.0000000
|
|
P 6
|
|
1 859.87676601 0.0016947
|
|
2 218.96050941 0.0123347
|
|
3 72.36853323 0.0595117
|
|
4 26.91710141 0.1978127
|
|
5 10.77497489 0.4105647
|
|
6 4.5232396 0.4752120
|
|
P 1
|
|
1 1.9871673 1.0000000
|
|
P 1
|
|
1 0.90649824 1.0000000
|
|
P 1
|
|
1 0.33862386 1.0000000
|
|
P 1
|
|
1 0.1192500 1.0000000
|
|
D 1
|
|
1 0.9751542 1.0000000
|
|
D 1
|
|
1 0.32573949 1.0000000
|
|
F 1
|
|
1 0.72996999 1.0000000
|
|
|
|
ARGON
|
|
S 5
|
|
1 163430.88636138 0.0018819
|
|
2 24462.98316426 0.0144019
|
|
3 5847.3915545 0.0668252
|
|
4 1838.33954786 0.2332980
|
|
5 646.47797239 0.7560303
|
|
S 2
|
|
1 233.37419769 0.3668742
|
|
2 87.35339236 0.6717833
|
|
S 1
|
|
1 35.25747909 1.0000000
|
|
S 1
|
|
1 14.90945611 1.0000000
|
|
S 1
|
|
1 5.16577808 1.0000000
|
|
S 1
|
|
1 2.13251221 1.0000000
|
|
S 1
|
|
1 0.66446873 1.0000000
|
|
S 1
|
|
1 0.23088302 1.0000000
|
|
P 6
|
|
1 1434.65644528 0.0009605
|
|
2 344.67516841 0.0078136
|
|
3 111.24392588 0.0412965
|
|
4 39.84545454 0.1614339
|
|
5 15.22684292 0.3997146
|
|
6 6.12548056 0.5354572
|
|
P 1
|
|
1 2.61266778 1.0000000
|
|
P 1
|
|
1 1.09059943 1.0000000
|
|
P 1
|
|
1 0.40193082 1.0000000
|
|
P 1
|
|
1 0.14113163 1.0000000
|
|
D 1
|
|
1 1.1910940 1.0000000
|
|
D 1
|
|
1 0.3931550 1.0000000
|
|
F 1
|
|
1 0.90998994 1.0000000
|
|
|
|
POTASSIUM
|
|
S 7
|
|
1 428242.30424475 0.0001877
|
|
2 65580.1599402 0.0013967
|
|
3 15724.19413173 0.0066209
|
|
4 4872.57135995 0.0240482
|
|
5 1690.37044379 0.0836524
|
|
6 598.8007531 0.2709211
|
|
7 218.82354539 0.6973223
|
|
S 2
|
|
1 4.63827453 -0.7910399
|
|
2 2.08136315 -0.2287964
|
|
S 1
|
|
1 84.45415215 1.0000000
|
|
S 1
|
|
1 34.00275517 1.0000000
|
|
S 1
|
|
1 10.41692419 1.0000000
|
|
S 1
|
|
1 0.74500339 1.0000000
|
|
S 1
|
|
1 0.28931658 1.0000000
|
|
S 1
|
|
1 0.03508468 1.0000000
|
|
S 1
|
|
1 0.01510794 1.0000000
|
|
P 5
|
|
1 2570.2521092 0.0015772
|
|
2 642.60993702 0.0119879
|
|
3 222.4540569 0.0585185
|
|
4 85.30416109 0.2417230
|
|
5 34.01212437 0.7678126
|
|
P 2
|
|
1 14.08906645 0.4876746
|
|
2 6.05154655 0.5646352
|
|
P 3
|
|
1 1.10953771 0.4078963
|
|
2 0.4515954 0.5090201
|
|
3 0.17668488 0.1926648
|
|
P 1
|
|
1 2.67407506 1.0000000
|
|
P 1
|
|
1 1.0769830 1.0000000
|
|
P 1
|
|
1 0.0375710 1.0000000
|
|
D 1
|
|
1 0.57805998 1.0000000
|
|
D 1
|
|
1 0.0919200 1.0000000
|
|
F 1
|
|
1 0.4513650 1.0000000
|
|
|
|
CALCIUM
|
|
S 7
|
|
1 502156.43635907 0.0001864
|
|
2 77161.57170187 0.0013813
|
|
3 18494.2633657 0.0065822
|
|
4 5704.10665829 0.0240595
|
|
5 1983.41527239 0.0828156
|
|
6 709.03282348 0.2667645
|
|
7 260.34379921 0.7012548
|
|
S 2
|
|
1 5.6374806 0.7250317
|
|
2 2.61572246 0.2967466
|
|
S 1
|
|
1 100.13007953 1.0000000
|
|
S 1
|
|
1 39.92937639 1.0000000
|
|
S 1
|
|
1 12.24168235 1.0000000
|
|
S 1
|
|
1 0.9133347 1.0000000
|
|
S 1
|
|
1 0.37450407 1.0000000
|
|
S 1
|
|
1 0.06817094 1.0000000
|
|
S 1
|
|
1 0.02739488 1.0000000
|
|
P 7
|
|
1 3357.47196305 0.0003367
|
|
2 824.07694278 0.0026750
|
|
3 283.71829232 0.0130102
|
|
4 111.35681721 0.0521147
|
|
5 45.58875729 0.1695694
|
|
6 19.24822394 0.3837893
|
|
7 8.34838921 0.5193456
|
|
P 2
|
|
1 0.61370116 0.7599749
|
|
2 0.24079998 0.2899168
|
|
P 1
|
|
1 3.71552342 1.0000000
|
|
P 1
|
|
1 1.4938680 1.0000000
|
|
P 1
|
|
1 0.0660000 1.0000000
|
|
P 1
|
|
1 0.0235000 1.0000000
|
|
D 1
|
|
1 3.4694000 1.0000000
|
|
D 1
|
|
1 0.7173000 1.0000000
|
|
D 1
|
|
1 0.15552959 1.0000000
|
|
D 1
|
|
1 0.07339198 1.0000000
|
|
F 1
|
|
1 0.12801489 1.0000000
|
|
|
|
SCANDIUM
|
|
S 7
|
|
1 605916.5255656 0.0001758
|
|
2 92019.5154601 0.0013166
|
|
3 22175.41439313 0.0061531
|
|
4 6936.8964504 0.0221907
|
|
5 2401.91423272 0.0787486
|
|
6 843.00307187 0.2622433
|
|
7 304.1681387 0.7111752
|
|
S 2
|
|
1 6.44408249 0.7179120
|
|
2 3.00072913 0.3039865
|
|
S 1
|
|
1 115.31901425 1.0000000
|
|
S 1
|
|
1 45.46057506 1.0000000
|
|
S 1
|
|
1 13.81085805 1.0000000
|
|
S 1
|
|
1 1.06543674 1.0000000
|
|
S 1
|
|
1 0.43727328 1.0000000
|
|
S 1
|
|
1 0.07749891 1.0000000
|
|
S 1
|
|
1 0.03042401 1.0000000
|
|
P 5
|
|
1 2720.38790516 0.0019267
|
|
2 674.78077209 0.0148071
|
|
3 234.86636943 0.0686858
|
|
4 93.73261226 0.2546559
|
|
5 39.24722635 0.7435003
|
|
P 2
|
|
1 16.90317148 0.4975834
|
|
2 7.49344569 0.5512435
|
|
P 3
|
|
1 1.46959989 0.4468526
|
|
2 0.62560248 0.4990286
|
|
3 0.25120559 0.1491527
|
|
P 1
|
|
1 3.38297427 1.0000000
|
|
P 1
|
|
1 1.2961925 1.0000000
|
|
P 1
|
|
1 0.12122172 1.0000000
|
|
D 4
|
|
1 28.68381257 0.0226491
|
|
2 7.99563996 0.1256610
|
|
3 2.71957237 0.3794531
|
|
4 0.99291023 0.6492698
|
|
D 1
|
|
1 0.35646045 1.0000000
|
|
D 1
|
|
1 0.11815477 1.0000000
|
|
F 1
|
|
1 0.78668857 1.0000000
|
|
F 1
|
|
1 0.18780739 1.0000000
|
|
G 1
|
|
1 0.25087235 1.0000000
|
|
|
|
TITANIUM
|
|
S 7
|
|
1 646272.54553266 0.0001775
|
|
2 97343.3308770 0.0013581
|
|
3 22968.17268697 0.0065305
|
|
4 7176.04654679 0.0228821
|
|
5 2544.45710412 0.0784762
|
|
6 902.16205812 0.2624193
|
|
7 325.14411596 0.7104832
|
|
S 2
|
|
1 6.64956473 0.8312864
|
|
2 2.98094682 0.1856946
|
|
S 1
|
|
1 123.23033275 1.0000000
|
|
S 1
|
|
1 48.7107942 1.0000000
|
|
S 1
|
|
1 14.66061377 1.0000000
|
|
S 1
|
|
1 1.14241496 1.0000000
|
|
S 1
|
|
1 0.46857899 1.0000000
|
|
S 1
|
|
1 0.0906186 1.0000000
|
|
S 1
|
|
1 0.03445845 1.0000000
|
|
P 5
|
|
1 3248.36091157 0.0018341
|
|
2 816.32685098 0.0136948
|
|
3 289.50230702 0.0623833
|
|
4 115.61204698 0.2426287
|
|
5 47.48969917 0.7603724
|
|
P 2
|
|
1 20.02919803 0.4884072
|
|
2 8.72643217 0.5622771
|
|
P 3
|
|
1 1.67787534 0.4566990
|
|
2 0.71101331 0.4942138
|
|
3 0.28476984 0.1441350
|
|
P 1
|
|
1 3.88827249 1.0000000
|
|
P 1
|
|
1 0.52792995 1.0000000
|
|
P 1
|
|
1 0.08493546 1.0000000
|
|
D 4
|
|
1 35.56176533 0.0210976
|
|
2 10.01786172 0.1213192
|
|
3 3.43558914 0.3758436
|
|
4 1.26885915 0.6529358
|
|
D 1
|
|
1 0.46038122 1.0000000
|
|
D 1
|
|
1 0.15351032 1.0000000
|
|
F 1
|
|
1 1.31180586 1.0000000
|
|
F 1
|
|
1 0.28660164 1.0000000
|
|
G 1
|
|
1 0.41782879 1.0000000
|
|
|
|
VANADIUM
|
|
S 5
|
|
1 382796.5443753 0.0020194
|
|
2 59594.4486003 0.0146232
|
|
3 14466.99258819 0.0684331
|
|
4 4581.00102074 0.2329788
|
|
5 1658.33170955 0.7530499
|
|
S 2
|
|
1 612.5470466 0.3186128
|
|
2 231.90521916 0.7165268
|
|
S 2
|
|
1 93.04133845 0.7070989
|
|
2 39.58972598 0.3207430
|
|
S 2
|
|
1 1.85860318 0.3082062
|
|
2 0.89729298 0.7119358
|
|
S 1
|
|
1 13.65265007 1.0000000
|
|
S 1
|
|
1 5.81532637 1.0000000
|
|
S 1
|
|
1 0.39449284 1.0000000
|
|
S 1
|
|
1 0.10161519 1.0000000
|
|
S 1
|
|
1 0.03690766 1.0000000
|
|
P 5
|
|
1 3273.03183543 0.0020121
|
|
2 808.43188145 0.0155517
|
|
3 283.72213742 0.0699679
|
|
4 115.75624011 0.2515137
|
|
5 49.08382545 0.7434837
|
|
P 2
|
|
1 21.18405615 0.4975856
|
|
2 9.39221356 0.5512295
|
|
P 3
|
|
1 1.86413842 0.4613038
|
|
2 0.79866128 0.4895271
|
|
3 0.32150583 0.1424719
|
|
P 1
|
|
1 4.23078847 1.0000000
|
|
P 1
|
|
1 0.10355646 1.0000000
|
|
P 1
|
|
1 0.03402692 1.0000000
|
|
D 4
|
|
1 41.34893968 0.0208341
|
|
2 11.71269791 0.1220424
|
|
3 4.04341124 0.3780819
|
|
4 1.5052845 0.6487692
|
|
D 1
|
|
1 0.55113758 1.0000000
|
|
D 1
|
|
1 0.1852745 1.0000000
|
|
F 1
|
|
1 1.83294725 1.0000000
|
|
F 1
|
|
1 0.4100393 1.0000000
|
|
G 1
|
|
1 0.6523293 1.0000000
|
|
|
|
CHROMIUM
|
|
S 5
|
|
1 371840.83425175 -0.0022591
|
|
2 57760.41387925 -0.0162832
|
|
3 14203.9954176 -0.0740509
|
|
4 4651.38191013 -0.2350433
|
|
5 1742.02500652 -0.7438198
|
|
S 2
|
|
1 653.32356524 0.3204225
|
|
2 249.17881444 0.7143420
|
|
S 2
|
|
1 100.48777042 0.7143943
|
|
2 42.94066869 0.3127989
|
|
S 2
|
|
1 2.03695593 0.3341136
|
|
2 0.96661184 0.6879018
|
|
S 1
|
|
1 14.94012939 1.0000000
|
|
S 1
|
|
1 6.38335649 1.0000000
|
|
S 1
|
|
1 0.41745662 1.0000000
|
|
S 1
|
|
1 0.09752435 1.0000000
|
|
S 1
|
|
1 0.0355168 1.0000000
|
|
P 5
|
|
1 3394.79326344 0.0020531
|
|
2 841.97565606 0.0157150
|
|
3 295.6383339 0.0708838
|
|
4 120.04772453 0.2553396
|
|
5 50.82984032 0.7396122
|
|
P 2
|
|
1 21.9956769 0.5134210
|
|
2 9.78856316 0.5350852
|
|
P 3
|
|
1 1.94928403 0.4816761
|
|
2 0.83286577 0.4755775
|
|
3 0.33109419 0.1365759
|
|
P 1
|
|
1 4.38095143 1.0000000
|
|
P 1
|
|
1 0.57849859 1.0000000
|
|
P 1
|
|
1 0.1011135 1.0000000
|
|
D 4
|
|
1 40.30032527 0.0245624
|
|
2 11.34339345 0.1386985
|
|
3 3.89821928 0.3985086
|
|
4 1.41772019 0.6232312
|
|
D 1
|
|
1 0.49405207 1.0000000
|
|
D 1
|
|
1 0.15425405 1.0000000
|
|
F 1
|
|
1 2.45712691 1.0000000
|
|
F 1
|
|
1 0.5893074 1.0000000
|
|
G 1
|
|
1 1.65808166 1.0000000
|
|
|
|
MANGANESE
|
|
S 6
|
|
1 429540.06806178 0.0005903
|
|
2 66091.05492852 0.0044544
|
|
3 15878.41303349 0.0204061
|
|
4 4876.21751062 0.0783264
|
|
5 1706.44219392 0.2383328
|
|
6 627.71058573 0.7347178
|
|
S 2
|
|
1 94.79049527 0.8444216
|
|
2 39.56789996 0.1744926
|
|
S 2
|
|
1 2.07437417 0.4445749
|
|
2 0.90153184 0.5859364
|
|
S 1
|
|
1 238.54978944 1.0000000
|
|
S 1
|
|
1 14.13947137 1.0000000
|
|
S 1
|
|
1 6.06826747 1.0000000
|
|
S 1
|
|
1 0.34113166 1.0000000
|
|
S 1
|
|
1 0.14381634 1.0000000
|
|
S 1
|
|
1 0.04484853 1.0000000
|
|
P 5
|
|
1 4166.05249107 0.0017719
|
|
2 1046.24233843 0.0133538
|
|
3 365.34448672 0.0635076
|
|
4 143.76758603 0.2484773
|
|
5 59.25695741 0.7545719
|
|
P 2
|
|
1 25.29265048 0.5046705
|
|
2 11.15359383 0.5448182
|
|
P 3
|
|
1 2.1838059 0.4905268
|
|
2 0.93649893 0.4701474
|
|
3 0.3858669 0.1293254
|
|
P 1
|
|
1 4.93531643 1.0000000
|
|
P 1
|
|
1 0.40673693 1.0000000
|
|
P 1
|
|
1 0.1286669 1.0000000
|
|
D 4
|
|
1 50.20195531 0.0205102
|
|
2 15.12550375 0.1105763
|
|
3 5.41876842 0.3484869
|
|
4 1.90612247 0.6898816
|
|
D 1
|
|
1 0.72104244 1.0000000
|
|
D 1
|
|
1 0.57896503 1.0000000
|
|
F 1
|
|
1 5.12596497 1.0000000
|
|
F 1
|
|
1 1.13004203 1.0000000
|
|
G 1
|
|
1 1.78996503 1.0000000
|
|
|
|
IRON
|
|
S 6
|
|
1 489363.91999756 0.0005968
|
|
2 76936.88249538 0.0042319
|
|
3 19111.87896905 0.0191663
|
|
4 5953.14711781 0.0712068
|
|
5 2026.23124631 0.2475797
|
|
6 720.41679913 0.7343498
|
|
S 2
|
|
1 109.11058782 0.7286287
|
|
2 46.72162464 0.2976594
|
|
S 2
|
|
1 2.44747866 0.3677907
|
|
2 1.1660482 0.6550487
|
|
S 1
|
|
1 270.92857792 1.0000000
|
|
S 1
|
|
1 17.32120133 1.0000000
|
|
S 1
|
|
1 7.50518249 1.0000000
|
|
S 1
|
|
1 0.53243004 1.0000000
|
|
S 1
|
|
1 0.11921823 1.0000000
|
|
S 1
|
|
1 0.04225089 1.0000000
|
|
P 5
|
|
1 4524.59978956 0.0017564
|
|
2 1117.10671951 0.0137791
|
|
3 383.18041997 0.0669482
|
|
4 150.91292643 0.2547675
|
|
5 63.20731062 0.7451150
|
|
P 2
|
|
1 27.51598778 0.5050259
|
|
2 12.38754653 0.5421365
|
|
P 3
|
|
1 2.50956697 0.4775810
|
|
2 1.07890467 0.4800877
|
|
3 0.43388971 0.1338830
|
|
P 1
|
|
1 5.64019838 1.0000000
|
|
P 1
|
|
1 0.8195210 1.0000000
|
|
P 1
|
|
1 0.42475725 1.0000000
|
|
D 4
|
|
1 57.37689087 0.0216251
|
|
2 16.5000892 0.1282788
|
|
3 5.79890555 0.3870228
|
|
4 2.17706897 0.6341162
|
|
D 1
|
|
1 0.26063792 1.0000000
|
|
D 1
|
|
1 0.79292368 1.0000000
|
|
F 1
|
|
1 3.44034529 1.0000000
|
|
F 1
|
|
1 0.84589748 1.0000000
|
|
G 1
|
|
1 2.25265017 1.0000000
|
|
|
|
COBALT
|
|
S 6
|
|
1 515660.56296198 0.0005473
|
|
2 79136.68588209 0.0040906
|
|
3 18893.17807046 0.0194637
|
|
4 5666.9486778 0.0760884
|
|
5 1915.33483556 0.2505790
|
|
6 692.58658589 0.7273192
|
|
S 2
|
|
1 108.30104845 0.7951522
|
|
2 46.24415274 0.2268945
|
|
S 2
|
|
1 2.49666399 0.4368043
|
|
2 1.04782429 0.5960151
|
|
S 1
|
|
1 265.6946591 1.0000000
|
|
S 1
|
|
1 18.13712769 1.0000000
|
|
S 1
|
|
1 7.85291973 1.0000000
|
|
S 1
|
|
1 0.92129386 1.0000000
|
|
S 1
|
|
1 0.20269592 1.0000000
|
|
S 1
|
|
1 0.05000013 1.0000000
|
|
P 5
|
|
1 5153.06513449 0.0016307
|
|
2 1263.81410825 0.0130886
|
|
3 426.49003119 0.0661160
|
|
4 165.78016797 0.2555168
|
|
5 69.31151396 0.7456924
|
|
P 2
|
|
1 30.26348395 0.5023420
|
|
2 13.63305677 0.5447305
|
|
P 3
|
|
1 2.7557468 0.4797893
|
|
2 1.18735239 0.4775383
|
|
3 0.47816165 0.1340387
|
|
P 1
|
|
1 6.17761123 1.0000000
|
|
P 1
|
|
1 0.31340765 1.0000000
|
|
P 1
|
|
1 0.12716165 1.0000000
|
|
D 4
|
|
1 63.6666883 0.0220408
|
|
2 18.56102053 0.1290119
|
|
3 6.63913369 0.3843690
|
|
4 2.5331891 0.6324399
|
|
D 1
|
|
1 0.93187834 1.0000000
|
|
D 1
|
|
1 0.30592586 1.0000000
|
|
F 1
|
|
1 3.93382585 1.0000000
|
|
F 1
|
|
1 0.96271584 1.0000000
|
|
G 1
|
|
1 2.4421237 1.0000000
|
|
|
|
NICKEL
|
|
S 6
|
|
1 373105.93515555 0.0009134
|
|
2 59462.29397186 0.0063858
|
|
3 15372.00196534 0.0258459
|
|
4 5197.42804044 0.0849311
|
|
5 2009.65356806 0.2328509
|
|
6 770.61858677 0.7262716
|
|
S 2
|
|
1 116.59982958 0.8544774
|
|
2 47.93114813 0.1640996
|
|
S 2
|
|
1 2.87511599 0.4321005
|
|
2 1.23408675 0.5990383
|
|
S 1
|
|
1 294.46332193 1.0000000
|
|
S 1
|
|
1 18.39222261 1.0000000
|
|
S 1
|
|
1 7.89683314 1.0000000
|
|
S 1
|
|
1 0.50522737 1.0000000
|
|
S 1
|
|
1 0.14887195 1.0000000
|
|
S 1
|
|
1 0.05021283 1.0000000
|
|
P 5
|
|
1 4816.62180566 0.0021333
|
|
2 1203.67523284 0.0160115
|
|
3 430.57602654 0.0698749
|
|
4 178.46092103 0.2493057
|
|
5 76.37589921 0.7439765
|
|
P 2
|
|
1 33.20021885 0.5018297
|
|
2 14.81701297 0.5462830
|
|
P 3
|
|
1 2.98032196 0.4827393
|
|
2 1.29229106 0.4738154
|
|
3 0.52229171 0.1339948
|
|
P 1
|
|
1 6.62308548 1.0000000
|
|
P 1
|
|
1 0.51697971 1.0000000
|
|
P 1
|
|
1 0.13229171 1.0000000
|
|
D 4
|
|
1 72.04700293 0.0211151
|
|
2 20.2359781 0.1368421
|
|
3 6.93843531 0.4130873
|
|
4 2.64335261 0.6027172
|
|
D 1
|
|
1 1.0917288 1.0000000
|
|
D 1
|
|
1 0.42501219 1.0000000
|
|
F 1
|
|
1 4.53550658 1.0000000
|
|
F 1
|
|
1 1.12300849 1.0000000
|
|
G 1
|
|
1 2.88175814 1.0000000
|
|
|
|
COPPER
|
|
S 6
|
|
1 514669.00652938 0.0006390
|
|
2 80118.78677097 0.0046666
|
|
3 19651.16415339 0.0210137
|
|
4 6138.22262671 0.0778557
|
|
5 2144.26659637 0.2474630
|
|
6 784.58098632 0.7264601
|
|
S 2
|
|
1 122.27577734 -0.8232649
|
|
2 51.72737096 -0.1969640
|
|
S 2
|
|
1 3.15166869 0.3964330
|
|
2 1.44088933 0.6296844
|
|
S 1
|
|
1 301.01834491 1.0000000
|
|
S 1
|
|
1 21.04214566 1.0000000
|
|
S 1
|
|
1 9.27995286 1.0000000
|
|
S 1
|
|
1 0.62462574 1.0000000
|
|
S 1
|
|
1 0.11348979 1.0000000
|
|
S 1
|
|
1 0.03941851 1.0000000
|
|
P 5
|
|
1 5815.43818215 0.0016506
|
|
2 1428.1485126 0.0131726
|
|
3 483.76133521 0.0661097
|
|
4 188.24449511 0.2559165
|
|
5 78.57208428 0.7454289
|
|
P 2
|
|
1 34.30720509 0.5144728
|
|
2 15.51857462 0.5322069
|
|
P 3
|
|
1 3.15455527 0.4937634
|
|
2 1.34968484 0.4692823
|
|
3 0.53361631 0.1295138
|
|
P 1
|
|
1 7.05295772 1.0000000
|
|
P 1
|
|
1 0.51818426 1.0000000
|
|
P 1
|
|
1 0.13161631 1.0000000
|
|
D 4
|
|
1 67.4683495 0.0254219
|
|
2 19.40941207 0.1470340
|
|
3 6.83244583 0.4084990
|
|
4 2.5180828 0.6043613
|
|
D 1
|
|
1 0.87575787 1.0000000
|
|
D 1
|
|
1 0.26512479 1.0000000
|
|
F 1
|
|
1 5.24160474 1.0000000
|
|
F 1
|
|
1 1.31383979 1.0000000
|
|
G 1
|
|
1 3.82922469 1.0000000
|
|
|
|
ZINC
|
|
S 6
|
|
1 632269.42234494 0.0005414
|
|
2 97330.39213669 0.0040486
|
|
3 23229.36397788 0.0191992
|
|
4 6954.81046053 0.0758474
|
|
5 2345.15364221 0.2481957
|
|
6 845.83553843 0.7300929
|
|
S 2
|
|
1 131.33289185 0.8271188
|
|
2 55.53933652 0.1927921
|
|
S 2
|
|
1 3.26289021 -0.4385668
|
|
2 1.48120849 -0.5888889
|
|
S 1
|
|
1 323.52764293 1.0000000
|
|
S 1
|
|
1 22.53801532 1.0000000
|
|
S 1
|
|
1 9.93529165 1.0000000
|
|
S 1
|
|
1 0.66767333 1.0000000
|
|
S 1
|
|
1 0.1491595 1.0000000
|
|
S 1
|
|
1 0.05038198 1.0000000
|
|
P 5
|
|
1 7605.80726948 0.0015234
|
|
2 1880.87976786 0.0120384
|
|
3 644.74368017 0.0600311
|
|
4 252.82500109 0.2405551
|
|
5 105.07693481 0.7635159
|
|
P 2
|
|
1 45.4277273 0.4669305
|
|
2 20.31898926 0.5804217
|
|
P 3
|
|
1 4.00257206 0.4500796
|
|
2 1.68190398 0.4941440
|
|
3 0.66116514 0.1554178
|
|
P 1
|
|
1 9.28757291 1.0000000
|
|
P 1
|
|
1 0.15416514 1.0000000
|
|
P 1
|
|
1 0.04296514 1.0000000
|
|
D 4
|
|
1 81.07284805 0.0227508
|
|
2 23.52503027 0.1365094
|
|
3 8.37197053 0.3975914
|
|
4 3.1540487 0.6174571
|
|
D 1
|
|
1 1.1394891 1.0000000
|
|
D 1
|
|
1 0.36653517 1.0000000
|
|
F 1
|
|
1 6.01613512 1.0000000
|
|
F 1
|
|
1 1.54356517 1.0000000
|
|
G 1
|
|
1 4.4096349 1.0000000
|
|
|
|
GALLIUM
|
|
S 7
|
|
1 1102887.70666042 0.0002067
|
|
2 170974.0717133 0.0015001
|
|
3 42016.06290563 0.0068335
|
|
4 13337.16526367 0.0241962
|
|
5 4691.67551291 0.0834692
|
|
6 1680.66430812 0.2685469
|
|
7 620.48404958 0.6983694
|
|
S 2
|
|
1 14.18696919 0.9374381
|
|
2 6.2018460 0.0702652
|
|
S 1
|
|
1 241.03180584 1.0000000
|
|
S 1
|
|
1 97.56478545 1.0000000
|
|
S 1
|
|
1 30.85759314 1.0000000
|
|
S 1
|
|
1 2.63208419 1.0000000
|
|
S 1
|
|
1 1.09317366 1.0000000
|
|
S 1
|
|
1 0.20365719 1.0000000
|
|
S 1
|
|
1 0.07224917 1.0000000
|
|
P 5
|
|
1 7740.51474845 0.0020777
|
|
2 2034.6007595 0.0133679
|
|
3 836.42878494 0.0452125
|
|
4 354.15721189 0.2066019
|
|
5 139.00226887 0.8048520
|
|
P 2
|
|
1 55.91296562 0.4444999
|
|
2 23.50780499 0.6091832
|
|
P 3
|
|
1 4.19882541 0.4919156
|
|
2 1.72625524 0.4800092
|
|
3 0.69312138 0.1227969
|
|
P 1
|
|
1 10.23138041 1.0000000
|
|
P 1
|
|
1 0.18144312 1.0000000
|
|
P 1
|
|
1 0.05386066 1.0000000
|
|
D 4
|
|
1 103.71281366 0.0182519
|
|
2 30.01872205 0.1192101
|
|
3 10.64661425 0.3810317
|
|
4 4.04022357 0.6432649
|
|
D 1
|
|
1 1.48916029 1.0000000
|
|
D 1
|
|
1 0.49809605 1.0000000
|
|
F 1
|
|
1 7.04909596 1.0000000
|
|
F 1
|
|
1 1.87567603 1.0000000
|
|
G 1
|
|
1 5.07201575 1.0000000
|
|
|
|
GERMANIUM
|
|
S 7
|
|
1 1401429.17054334 0.0001938
|
|
2 218412.57389231 0.0013966
|
|
3 53747.55035209 0.0063836
|
|
4 17054.27506939 0.0225497
|
|
5 6037.72486321 0.0774292
|
|
6 2165.81977184 0.2558287
|
|
7 787.81226270 0.7166215
|
|
S 2
|
|
1 17.83982031 0.7424344
|
|
2 8.34041086 0.2780977
|
|
S 1
|
|
1 297.57998503 1.0000000
|
|
S 1
|
|
1 116.56487083 1.0000000
|
|
S 1
|
|
1 36.74739134 1.0000000
|
|
S 1
|
|
1 3.10890301 1.0000000
|
|
S 1
|
|
1 1.29166443 1.0000000
|
|
S 1
|
|
1 0.25684439 1.0000000
|
|
S 1
|
|
1 0.09315123 1.0000000
|
|
P 7
|
|
1 7745.96880155 0.0004014
|
|
2 1978.69652784 0.0029199
|
|
3 698.74045757 0.0142129
|
|
4 268.69593788 0.0612986
|
|
5 106.56884189 0.2042266
|
|
6 44.03015572 0.4279629
|
|
7 18.94641267 0.4409516
|
|
P 2
|
|
1 3.51145972 -0.6149771
|
|
2 1.49539604 -0.4369854
|
|
P 1
|
|
1 7.99860913 1.0000000
|
|
P 1
|
|
1 0.54986175 1.0000000
|
|
P 1
|
|
1 0.19763607 1.0000000
|
|
P 1
|
|
1 0.06695373 1.0000000
|
|
D 4
|
|
1 116.40740836 0.0176259
|
|
2 33.85135964 0.1166536
|
|
3 12.09879241 0.3774910
|
|
4 4.65158978 0.6456349
|
|
D 1
|
|
1 1.75619118 1.0000000
|
|
D 1
|
|
1 0.60958492 1.0000000
|
|
F 1
|
|
1 7.89378482 1.0000000
|
|
F 1
|
|
1 2.1262849 1.0000000
|
|
G 1
|
|
1 5.83168488 1.0000000
|
|
|
|
ARSENIC
|
|
S 6
|
|
1 1620090.77430984 0.0005613
|
|
2 253883.03785313 0.0040434
|
|
3 61960.80113637 0.0188330
|
|
4 19301.82545774 0.0685224
|
|
5 6845.06109429 0.2272573
|
|
6 2489.5656297 0.7527716
|
|
S 2
|
|
1 907.78913473 0.3485282
|
|
2 340.9711903 0.6889212
|
|
S 2
|
|
1 22.04553688 -0.5987411
|
|
2 10.1678734 -0.4274838
|
|
S 1
|
|
1 133.08269345 1.0000000
|
|
S 1
|
|
1 45.43145026 1.0000000
|
|
S 1
|
|
1 3.56034848 1.0000000
|
|
S 1
|
|
1 1.49612889 1.0000000
|
|
S 1
|
|
1 0.31147788 1.0000000
|
|
S 1
|
|
1 0.11481262 1.0000000
|
|
P 7
|
|
1 8404.77216574 0.0003951
|
|
2 2145.26430812 0.0028696
|
|
3 763.94406154 0.0136569
|
|
4 297.03453437 0.0585033
|
|
5 118.37967159 0.1972540
|
|
6 49.00745021 0.4234229
|
|
7 21.13109555 0.4530918
|
|
P 2
|
|
1 3.97055501 -0.6091241
|
|
2 1.69738079 -0.4426070
|
|
P 1
|
|
1 9.03213766 1.0000000
|
|
P 1
|
|
1 0.61430936 1.0000000
|
|
P 1
|
|
1 0.23723063 1.0000000
|
|
P 1
|
|
1 0.08411413 1.0000000
|
|
D 4
|
|
1 133.38455994 0.0163625
|
|
2 38.87139406 0.1113155
|
|
3 13.94346919 0.3710149
|
|
4 5.40455892 0.6534747
|
|
D 1
|
|
1 2.07293388 1.0000000
|
|
D 1
|
|
1 0.73614276 1.0000000
|
|
F 1
|
|
1 8.9493600 1.0000000
|
|
F 1
|
|
1 2.45826995 1.0000000
|
|
G 1
|
|
1 6.66377991 1.0000000
|
|
|
|
SELENIUM
|
|
S 7
|
|
1 1685431.27012521 0.0001985
|
|
2 266562.34630843 0.0014035
|
|
3 65582.07818753 0.0065275
|
|
4 20465.14624585 0.0235454
|
|
5 7323.16994588 0.0769405
|
|
6 2704.24392067 0.2492729
|
|
7 993.08738388 0.7211690
|
|
S 2
|
|
1 24.55339156 0.5956581
|
|
2 11.22750778 0.4311927
|
|
S 1
|
|
1 373.11567865 1.0000000
|
|
S 1
|
|
1 145.63559041 1.0000000
|
|
S 1
|
|
1 51.37631704 1.0000000
|
|
S 1
|
|
1 3.89979257 1.0000000
|
|
S 1
|
|
1 1.66659814 1.0000000
|
|
S 1
|
|
1 0.37133202 1.0000000
|
|
S 1
|
|
1 0.13749933 1.0000000
|
|
P 7
|
|
1 8846.6360627 0.0004014
|
|
2 2264.47556538 0.0029017
|
|
3 806.31901855 0.0138560
|
|
4 313.10698513 0.0593977
|
|
5 124.80120211 0.1995966
|
|
6 51.74110702 0.4249480
|
|
7 22.35933682 0.4484166
|
|
P 2
|
|
1 4.22415016 -0.6181284
|
|
2 1.8305453 -0.4316993
|
|
P 1
|
|
1 9.54625228 1.0000000
|
|
P 1
|
|
1 0.65874681 1.0000000
|
|
P 1
|
|
1 0.25855726 1.0000000
|
|
P 1
|
|
1 0.09165027 1.0000000
|
|
D 4
|
|
1 152.15432734 0.0152087
|
|
2 44.42146636 0.1062069
|
|
3 15.98963157 0.3642433
|
|
4 6.24229525 0.6615534
|
|
D 1
|
|
1 2.42536692 1.0000000
|
|
D 1
|
|
1 0.87698775 1.0000000
|
|
F 1
|
|
1 9.93558771 1.0000000
|
|
F 1
|
|
1 2.77256768 1.0000000
|
|
G 1
|
|
1 7.47528684 1.0000000
|
|
|
|
BROMINE
|
|
S 7
|
|
1 1891721.28453019 0.0001951
|
|
2 299876.69022932 0.0013773
|
|
3 73577.47723328 0.0064598
|
|
4 22821.38425143 0.0234499
|
|
5 8196.66148892 0.0755164
|
|
6 3042.20569848 0.2462844
|
|
7 1114.04711267 0.7251121
|
|
S 2
|
|
1 27.88308617 -0.5531038
|
|
2 12.56697986 -0.4753004
|
|
S 1
|
|
1 416.79690877 1.0000000
|
|
S 1
|
|
1 162.83699705 1.0000000
|
|
S 1
|
|
1 60.95282138 1.0000000
|
|
S 1
|
|
1 4.29335357 1.0000000
|
|
S 1
|
|
1 1.86285469 1.0000000
|
|
S 1
|
|
1 0.43306174 1.0000000
|
|
S 1
|
|
1 0.1612887 1.0000000
|
|
P 7
|
|
1 9319.75302208 0.0004101
|
|
2 2376.91773965 0.0029768
|
|
3 850.05093709 0.0139690
|
|
4 333.27682069 0.0590393
|
|
5 133.67709985 0.1980826
|
|
6 55.61145698 0.4235857
|
|
7 24.09110501 0.4505557
|
|
P 2
|
|
1 4.59144998 -0.6213087
|
|
2 2.01522298 -0.4269487
|
|
P 1
|
|
1 10.32325402 1.0000000
|
|
P 1
|
|
1 0.74175022 1.0000000
|
|
P 1
|
|
1 0.29419421 1.0000000
|
|
P 1
|
|
1 0.10541093 1.0000000
|
|
D 4
|
|
1 168.94701922 0.0146161
|
|
2 49.42559982 0.1035747
|
|
3 17.8625704 0.3605887
|
|
4 7.02094166 0.6652561
|
|
D 1
|
|
1 2.76152556 1.0000000
|
|
D 1
|
|
1 1.0146000 1.0000000
|
|
F 1
|
|
1 10.92125998 1.0000000
|
|
F 1
|
|
1 3.0839599 1.0000000
|
|
G 1
|
|
1 8.36545878 1.0000000
|
|
|
|
KRYPTON
|
|
S 7
|
|
1 2022523.35400365 0.0001973
|
|
2 321581.18640634 0.0013896
|
|
3 78794.86535957 0.0065438
|
|
4 24367.24826888 0.0238428
|
|
5 8772.54852994 0.0759091
|
|
6 3279.34210313 0.2459612
|
|
7 1206.82451016 0.7243811
|
|
S 2
|
|
1 30.60063891 -0.5317094
|
|
2 13.71423656 -0.4972204
|
|
S 1
|
|
1 452.99814489 1.0000000
|
|
S 1
|
|
1 177.85360115 1.0000000
|
|
S 1
|
|
1 68.90077488 1.0000000
|
|
S 1
|
|
1 4.66990153 1.0000000
|
|
S 1
|
|
1 2.05586155 1.0000000
|
|
S 1
|
|
1 0.49911816 1.0000000
|
|
S 1
|
|
1 0.18661016 1.0000000
|
|
P 7
|
|
1 9855.05799761 0.0004155
|
|
2 2508.11351375 0.0030231
|
|
3 901.31751148 0.0139381
|
|
4 356.87438047 0.0581494
|
|
5 144.01862941 0.1952979
|
|
6 60.11769133 0.4212281
|
|
7 26.11649011 0.4551745
|
|
P 2
|
|
1 5.03265059 -0.6210458
|
|
2 2.2314183 -0.4260816
|
|
P 1
|
|
1 11.26568877 1.0000000
|
|
P 1
|
|
1 0.8376353 1.0000000
|
|
P 1
|
|
1 0.33526405 1.0000000
|
|
P 1
|
|
1 0.12144298 1.0000000
|
|
D 4
|
|
1 189.71163634 0.0137304
|
|
2 55.50837565 0.0995801
|
|
3 20.09178924 0.3552691
|
|
4 7.92942308 0.6718284
|
|
D 1
|
|
1 3.1451067 1.0000000
|
|
D 1
|
|
1 1.16837555 1.0000000
|
|
F 1
|
|
1 11.89747553 1.0000000
|
|
F 1
|
|
1 3.39377546 1.0000000
|
|
G 1
|
|
1 9.31937391 1.0000000
|
|
|
|
RUBIDIUM
|
|
S 8
|
|
1 3739746.25060054 0.0000830
|
|
2 577563.02778853 0.0006186
|
|
3 139835.54976157 0.0028433
|
|
4 43084.3825577 0.0109623
|
|
5 15426.57773886 0.0326035
|
|
6 6199.15697858 0.0955895
|
|
7 2579.69748769 0.2500748
|
|
8 1047.93768913 0.6883222
|
|
S 2
|
|
1 181.6181516 0.8423483
|
|
2 77.13409799 0.1760115
|
|
S 2
|
|
1 36.5460272 0.4167499
|
|
2 17.59772125 0.6065732
|
|
S 3
|
|
1 8.43711814 -0.0131954
|
|
2 4.19933738 -0.4890020
|
|
3 2.08598299 -0.5220114
|
|
S 1
|
|
1 428.62269126 1.0000000
|
|
S 1
|
|
1 0.80784511 1.0000000
|
|
S 1
|
|
1 0.40392907 1.0000000
|
|
S 1
|
|
1 0.1933064 1.0000000
|
|
S 1
|
|
1 0.02453644 1.0000000
|
|
P 8
|
|
1 18263.34077532 0.0001549
|
|
2 4376.45136895 0.0012921
|
|
3 1530.21368441 0.0059980
|
|
4 636.90362256 0.0232486
|
|
5 268.96109305 0.0864132
|
|
6 114.28545366 0.2446808
|
|
7 50.03178296 0.4327934
|
|
8 22.63971584 0.3635177
|
|
P 2
|
|
1 4.59261339 -0.6806365
|
|
2 2.13332672 -0.3586834
|
|
P 2
|
|
1 0.87560981 0.4126773
|
|
2 0.36688434 0.6400702
|
|
P 1
|
|
1 10.01200025 1.0000000
|
|
P 1
|
|
1 0.14550725 1.0000000
|
|
P 1
|
|
1 0.0632145845 1.0000000
|
|
P 1
|
|
1 0.019539569 1.0000000
|
|
D 5
|
|
1 126.33778704 0.0214803
|
|
2 36.70963339 0.1306672
|
|
3 13.04469742 0.3624986
|
|
4 4.83259033 0.4942769
|
|
5 1.70567407 0.2622603
|
|
D 1
|
|
1 0.41209482 1.0000000
|
|
D 1
|
|
1 0.06849964 1.0000000
|
|
F 1
|
|
1 0.07757084 1.0000000
|
|
|
|
STRONTIUM
|
|
S 8
|
|
1 3972749.1575594 0.0000985
|
|
2 629387.57724649 0.0006768
|
|
3 160641.02639354 0.0029714
|
|
4 54133.10173970 0.0091125
|
|
5 20774.61892731 0.0297443
|
|
6 8169.67344831 0.0868799
|
|
7 3215.36713876 0.2754877
|
|
8 1277.89996123 0.6758715
|
|
S 2
|
|
1 224.01514393 0.6891262
|
|
2 100.40338075 0.3362718
|
|
S 2
|
|
1 40.94062522 -0.3844710
|
|
2 18.64615505 -0.6415697
|
|
S 2
|
|
1 7.34438874 0.1407759
|
|
2 3.58734019 0.8701849
|
|
S 2
|
|
1 1.58103436 0.7497568
|
|
2 0.78721657 -1.6385248
|
|
S 1
|
|
1 523.07632825 1.0000000
|
|
S 1
|
|
1 0.32024672 1.0000000
|
|
S 1
|
|
1 0.05461593 1.0000000
|
|
S 1
|
|
1 0.02312861 1.0000000
|
|
P 8
|
|
1 19632.45735341 0.0001513
|
|
2 4833.71011221 0.0012135
|
|
3 1687.67584161 0.0057996
|
|
4 702.5907771 0.0217667
|
|
5 306.6120094 0.0763822
|
|
6 133.93861887 0.2203224
|
|
7 59.30687021 0.4198799
|
|
8 26.89582575 0.4059047
|
|
P 2
|
|
1 5.51818016 -0.6282658
|
|
2 2.57075714 -0.4132194
|
|
P 2
|
|
1 0.45231823 0.7721466
|
|
2 0.18184915 0.2737090
|
|
P 1
|
|
1 11.89604963 1.0000000
|
|
P 1
|
|
1 1.05030044 1.0000000
|
|
P 1
|
|
1 0.06011733 1.0000000
|
|
P 1
|
|
1 0.021858665 1.0000000
|
|
D 5
|
|
1 139.23181355 0.0205098
|
|
2 40.56354360 0.1266829
|
|
3 14.47143525 0.3582849
|
|
4 5.40148217 0.4967848
|
|
5 1.93070186 0.2633920
|
|
D 1
|
|
1 0.41534997 1.0000000
|
|
D 1
|
|
1 0.08607999 1.0000000
|
|
F 1
|
|
1 1.7110000 1.0000000
|
|
|
|
YTTRIUM
|
|
S 8
|
|
1 1019175.125097954 0.0004007
|
|
2 449419.574711232 0.0001809
|
|
3 171662.923365764 0.0025031
|
|
4 49796.091220839 0.0105755
|
|
5 18571.018027471 0.0253440
|
|
6 7548.777457342 0.0911525
|
|
7 2956.394415510 0.2386203
|
|
8 1159.861768860 0.7112264
|
|
S 2
|
|
1 471.314790838 0.4515983
|
|
2 198.746043157 0.5811614
|
|
S 2
|
|
1 82.449957668 -0.0164365
|
|
2 36.548606326 1.0145370
|
|
S 3
|
|
1 1.014104049 -0.2244691
|
|
2 0.445150894 -0.7235202
|
|
3 0.210813786 -0.0826356
|
|
S 1
|
|
1 16.610564860 1.0000000
|
|
S 1
|
|
1 5.971815267 1.0000000
|
|
S 1
|
|
1 2.743571223 1.0000000
|
|
S 1
|
|
1 0.070113149 1.0000000
|
|
S 1
|
|
1 0.034266669 1.0000000
|
|
P 8
|
|
1 9031.459440887 0.0005020
|
|
2 4471.047034087 0.0007282
|
|
3 1874.424209381 0.0055378
|
|
4 745.490992437 0.0233354
|
|
5 311.199933929 0.0836982
|
|
6 137.085910751 0.2227558
|
|
7 62.735106711 0.4082137
|
|
8 29.211720480 0.4044363
|
|
P 2
|
|
1 6.135442162 -0.6480929
|
|
2 2.836890969 -0.3933643
|
|
P 2
|
|
1 1.109439425 0.4301800
|
|
2 0.482239307 0.6192576
|
|
P 1
|
|
1 13.308991139 1.0000000
|
|
P 1
|
|
1 0.193122746 1.0000000
|
|
P 1
|
|
1 0.0691176865 1.0000000
|
|
D 6
|
|
1 314.433106165 0.0046691
|
|
2 95.506201654 0.0350661
|
|
3 36.485620822 0.1368580
|
|
4 15.410215419 0.3177322
|
|
5 6.661436739 0.4378494
|
|
6 2.836213724 0.3068684
|
|
D 1
|
|
1 1.064728901 1.0000000
|
|
D 1
|
|
1 0.383514444 1.0000000
|
|
D 1
|
|
1 0.120179497 1.0000000
|
|
F 1
|
|
1 0.5242900 1.0000000
|
|
F 1
|
|
1 0.1439650 1.0000000
|
|
G 1
|
|
1 0.2036100 1.0000000
|
|
|
|
ZIRCONIUM
|
|
S 8
|
|
1 2881766.00843883 0.0001262
|
|
2 459259.50306019 0.0009174
|
|
3 115812.49914978 0.0037528
|
|
4 38409.93674702 0.0135239
|
|
5 15094.96121921 0.0322024
|
|
6 6324.72914276 0.1077894
|
|
7 2701.92719494 0.2327755
|
|
8 1140.16705548 0.6903144
|
|
S 2
|
|
1 475.25432728 0.4634812
|
|
2 199.72185141 0.5697082
|
|
S 2
|
|
1 79.40724166 0.0143423
|
|
2 37.59776366 0.9870353
|
|
S 2
|
|
1 6.73358822 -0.3182567
|
|
2 3.17684312 -0.7035034
|
|
S 2
|
|
1 1.11296173 -0.3207506
|
|
2 0.55165529 -0.6984549
|
|
S 1
|
|
1 17.45622572 1.0000000
|
|
S 1
|
|
1 0.27156947 1.0000000
|
|
S 1
|
|
1 0.07556233 1.0000000
|
|
S 1
|
|
1 0.02920028 1.0000000
|
|
P 8
|
|
1 24663.76699452 0.0001258
|
|
2 5922.66530443 0.0010606
|
|
3 2038.48063845 0.0051487
|
|
4 848.76029892 0.0193661
|
|
5 368.40572403 0.0703717
|
|
6 159.18932911 0.2109443
|
|
7 69.92875282 0.4177935
|
|
8 31.59687339 0.4234156
|
|
P 2
|
|
1 6.56958849 -0.6323139
|
|
2 3.09912584 -0.4077113
|
|
P 2
|
|
1 0.57150585 0.7969512
|
|
2 0.23089432 0.2451254
|
|
P 1
|
|
1 14.06096181 1.0000000
|
|
P 1
|
|
1 1.30213681 1.0000000
|
|
P 1
|
|
1 0.06604994 1.0000000
|
|
D 6
|
|
1 359.92567155 0.0041444
|
|
2 103.79793357 0.0358607
|
|
3 37.37929762 0.1548002
|
|
4 15.0321095 0.3563795
|
|
5 6.3550516 0.4391444
|
|
6 2.72752584 0.2530055
|
|
D 1
|
|
1 1.02730802 1.0000000
|
|
D 1
|
|
1 0.37303308 1.0000000
|
|
D 1
|
|
1 0.12262696 1.0000000
|
|
F 1
|
|
1 0.68258997 1.0000000
|
|
F 1
|
|
1 0.1856970 1.0000000
|
|
G 1
|
|
1 0.2982622 1.0000000
|
|
|
|
NIOBIUM
|
|
S 9
|
|
1 8581145.70489003 0.0000314
|
|
2 1334483.17670774 0.0002251
|
|
3 335751.96683865 0.0009858
|
|
4 108364.02370685 0.0035174
|
|
5 38635.81925873 0.0118029
|
|
6 15200.86086205 0.0328573
|
|
7 6403.00310418 0.0932469
|
|
8 2604.97587129 0.2717258
|
|
9 1037.78813637 0.6699703
|
|
S 2
|
|
1 32.52586244 0.6152670
|
|
2 16.25422037 0.4056465
|
|
S 3
|
|
1 8.21909359 -0.1995278
|
|
2 4.0984597 -0.7055194
|
|
3 1.99299891 -0.1215283
|
|
S 1
|
|
1 424.59583204 1.0000000
|
|
S 1
|
|
1 179.67406691 1.0000000
|
|
S 1
|
|
1 64.52165986 1.0000000
|
|
S 1
|
|
1 0.86911871 1.0000000
|
|
S 1
|
|
1 0.37474072 1.0000000
|
|
S 1
|
|
1 0.05027146 1.0000000
|
|
P 8
|
|
1 23312.28561904 0.0001487
|
|
2 5595.66517542 0.0012498
|
|
3 1933.63166362 0.0059799
|
|
4 804.18342772 0.0226239
|
|
5 347.34982785 0.0809401
|
|
6 150.5830774 0.2310973
|
|
7 66.72624029 0.4247557
|
|
8 30.42864994 0.3864358
|
|
P 3
|
|
1 1.31522777 -0.4230135
|
|
2 0.57542713 -0.5186873
|
|
3 0.23135803 -0.1482279
|
|
P 1
|
|
1 13.43587225 1.0000000
|
|
P 1
|
|
1 6.30136511 1.0000000
|
|
P 1
|
|
1 3.01469641 1.0000000
|
|
P 1
|
|
1 0.10923773 1.0000000
|
|
P 1
|
|
1 0.038408235 1.0000000
|
|
D 6
|
|
1 311.20104364 0.0062905
|
|
2 91.20961137 0.0495466
|
|
3 33.33798508 0.1928070
|
|
4 13.52738611 0.3936532
|
|
5 5.75102961 0.4203029
|
|
6 2.48152082 0.1854851
|
|
D 1
|
|
1 0.94581911 1.0000000
|
|
D 1
|
|
1 0.33878094 1.0000000
|
|
D 1
|
|
1 0.10883689 1.0000000
|
|
F 1
|
|
1 0.89199207 1.0000000
|
|
F 1
|
|
1 0.24816112 1.0000000
|
|
G 1
|
|
1 0.65339081 1.0000000
|
|
|
|
MOLYBDENUM
|
|
S 8
|
|
1 2026740.93270436 0.0002054
|
|
2 385350.13660691 0.0009909
|
|
3 153625.66721216 0.0018066
|
|
4 59074.20718888 0.0092070
|
|
5 18926.56514348 0.0353847
|
|
6 7049.14637847 0.0983889
|
|
7 2906.91027690 0.2655676
|
|
8 1178.86891419 0.6716061
|
|
S 2
|
|
1 474.86543884 -0.5665737
|
|
2 193.86208674 -0.4688159
|
|
S 2
|
|
1 30.71565223 0.8305056
|
|
2 13.28375914 0.1880982
|
|
S 2
|
|
1 5.34972340 -0.8319494
|
|
2 1.94467514 -0.1949974
|
|
S 2
|
|
1 0.97320128 0.6671042
|
|
2 0.32190830 0.3817182
|
|
S 1
|
|
1 67.20988264 1.0000000
|
|
S 1
|
|
1 0.11839548 1.0000000
|
|
S 1
|
|
1 0.05367322 1.0000000
|
|
S 1
|
|
1 0.02683661 1.0000000
|
|
P 7
|
|
1 10863.79422813 0.0005857
|
|
2 3502.46398906 0.0024984
|
|
3 1407.06428281 0.0122642
|
|
4 537.92230924 0.0560023
|
|
5 218.13351373 0.1821024
|
|
6 94.27836494 0.4002267
|
|
7 42.46633549 0.4829808
|
|
P 2
|
|
1 8.99486403 -0.5715606
|
|
2 4.14037062 -0.4727762
|
|
P 3
|
|
1 1.68330345 0.3106762
|
|
2 0.73126273 0.5837458
|
|
3 0.29053886 0.1974514
|
|
P 1
|
|
1 19.68084827 1.0000000
|
|
P 1
|
|
1 0.1304384 1.0000000
|
|
P 1
|
|
1 0.0436769 1.0000000
|
|
P 1
|
|
1 0.02183845 1.0000000
|
|
D 6
|
|
1 260.39682190 0.0100876
|
|
2 77.45152306 0.0710367
|
|
3 28.75103788 0.2439763
|
|
4 11.59423933 0.4441040
|
|
5 4.72142252 0.3954699
|
|
6 1.73212087 0.0926277
|
|
D 1
|
|
1 0.60240161 1.0000000
|
|
D 1
|
|
1 0.17860241 1.0000000
|
|
D 1
|
|
1 0.2572650 1.0000000
|
|
F 1
|
|
1 1.1248440 1.0000000
|
|
F 1
|
|
1 0.3345650 1.0000000
|
|
G 1
|
|
1 0.8460700 1.0000000
|
|
|
|
TECHNETIUM
|
|
S 8
|
|
1 3851442.12082243 0.0001044
|
|
2 601894.41062970 0.0007757
|
|
3 147396.56793651 0.0034247
|
|
4 45997.14342831 0.0133530
|
|
5 17076.26837505 0.0341962
|
|
6 7235.03572475 0.1022002
|
|
7 3114.29165127 0.2381455
|
|
8 1291.51272929 0.6895597
|
|
S 2
|
|
1 536.49187914 0.4755495
|
|
2 228.26168657 0.5568936
|
|
S 2
|
|
1 93.49391735 -0.0080302
|
|
2 44.7763713 -0.9927239
|
|
S 2
|
|
1 8.13219362 0.3176392
|
|
2 3.97027924 0.7022555
|
|
S 2
|
|
1 1.40155346 0.3267130
|
|
2 0.73624261 0.6925507
|
|
S 1
|
|
1 21.03068506 1.0000000
|
|
S 1
|
|
1 0.34483142 1.0000000
|
|
S 1
|
|
1 0.08796117 1.0000000
|
|
S 1
|
|
1 0.03305765 1.0000000
|
|
P 8
|
|
1 21361.06367328 0.0002028
|
|
2 5210.47351838 0.0016575
|
|
3 1793.05084933 0.0081227
|
|
4 736.75031487 0.0302435
|
|
5 325.27714879 0.0973914
|
|
6 147.11397361 0.2487065
|
|
7 67.97459788 0.4165866
|
|
8 32.1692613 0.3518359
|
|
P 3
|
|
1 1.57647869 -0.4383684
|
|
2 0.69886263 -0.5145876
|
|
3 0.28297013 -0.1320041
|
|
P 1
|
|
1 14.85651725 1.0000000
|
|
P 1
|
|
1 7.11403457 1.0000000
|
|
P 1
|
|
1 3.46833982 1.0000000
|
|
P 1
|
|
1 0.1347980 1.0000000
|
|
D 6
|
|
1 447.75453162 0.0038414
|
|
2 131.59052776 0.0325961
|
|
3 48.70862067 0.1396272
|
|
4 20.11979669 0.3366093
|
|
5 8.6540380 0.4478713
|
|
6 3.7602712 0.2709887
|
|
D 1
|
|
1 1.42954012 1.0000000
|
|
D 1
|
|
1 0.51671554 1.0000000
|
|
D 1
|
|
1 0.16215083 1.0000000
|
|
F 1
|
|
1 1.28270863 1.0000000
|
|
F 1
|
|
1 0.36762817 1.0000000
|
|
G 1
|
|
1 0.93323847 1.0000000
|
|
|
|
RUTHENIUM
|
|
S 9
|
|
1 3451353.77133021 0.0000651
|
|
2 551105.70533797 0.0004540
|
|
3 138967.53809736 0.0019887
|
|
4 46179.70036789 0.0063933
|
|
5 18196.70909004 0.0178657
|
|
6 7630.49261861 0.0493781
|
|
7 3268.28428882 0.1288321
|
|
8 1384.25505096 0.3171524
|
|
9 577.78384552 0.5771269
|
|
S 2
|
|
1 45.96443513 0.4570877
|
|
2 21.52457434 0.5685881
|
|
S 2
|
|
1 8.50673097 -0.3508182
|
|
2 4.15824427 -0.6700702
|
|
S 2
|
|
1 1.50459353 0.3873032
|
|
2 0.75114502 0.6333086
|
|
S 1
|
|
1 242.7478171 1.0000000
|
|
S 1
|
|
1 95.96985639 1.0000000
|
|
S 1
|
|
1 0.34819762 1.0000000
|
|
S 1
|
|
1 0.09005437 1.0000000
|
|
S 1
|
|
1 0.03339473 1.0000000
|
|
P 8
|
|
1 19642.60840236 0.0002538
|
|
2 4869.87473272 0.0019849
|
|
3 1737.63901211 0.0087928
|
|
4 756.86571627 0.0291888
|
|
5 348.20633344 0.0922582
|
|
6 158.90824418 0.2425449
|
|
7 73.0738836 0.4181040
|
|
8 34.27481392 0.3609867
|
|
P 3
|
|
1 1.68178301 -0.4480400
|
|
2 0.74854220 -0.4997321
|
|
3 0.30426518 -0.1388506
|
|
P 1
|
|
1 15.56264412 1.0000000
|
|
P 1
|
|
1 7.46068575 1.0000000
|
|
P 1
|
|
1 3.65121502 1.0000000
|
|
P 1
|
|
1 0.13584226 1.0000000
|
|
P 1
|
|
1 0.04162421 1.0000000
|
|
D 6
|
|
1 465.02610233 0.0040302
|
|
2 134.44135236 0.0354913
|
|
3 48.68057637 0.1560031
|
|
4 19.69075263 0.3659746
|
|
5 8.37951695 0.4465826
|
|
6 3.64916324 0.2261633
|
|
D 1
|
|
1 1.43403385 1.0000000
|
|
D 1
|
|
1 0.52668865 1.0000000
|
|
D 1
|
|
1 0.16935441 1.0000000
|
|
F 1
|
|
1 1.41208879 1.0000000
|
|
F 1
|
|
1 0.4107260 1.0000000
|
|
G 1
|
|
1 1.08232217 1.0000000
|
|
|
|
RHODIUM
|
|
S 11
|
|
1 3804470.52408509 0.0000395
|
|
2 600319.14750127 0.0002798
|
|
3 149593.65972544 0.0012531
|
|
4 48336.10505841 0.0042848
|
|
5 18188.07860651 0.0127092
|
|
6 7505.67531466 0.0340741
|
|
7 3219.39994412 0.0891361
|
|
8 1360.38210008 0.2149321
|
|
9 572.67177209 0.3747010
|
|
10 245.20087692 0.3368771
|
|
11 97.56087173 0.0822027
|
|
S 2
|
|
1 12.8076254 0.2779630
|
|
2 6.39415092 0.7393337
|
|
S 1
|
|
1 49.23997807 1.0000000
|
|
S 1
|
|
1 24.26668673 1.0000000
|
|
S 1
|
|
1 3.28414542 1.0000000
|
|
S 1
|
|
1 1.33169217 1.0000000
|
|
S 1
|
|
1 0.5635270 1.0000000
|
|
S 1
|
|
1 0.09145209 1.0000000
|
|
S 1
|
|
1 0.03434845 1.0000000
|
|
P 7
|
|
1 21431.18615042 0.0003251
|
|
2 5282.46137798 0.0025902
|
|
3 1849.44795946 0.0121295
|
|
4 779.23486071 0.0428659
|
|
5 351.40609708 0.1349209
|
|
6 160.37585747 0.3446276
|
|
7 74.16789163 0.5767487
|
|
P 2
|
|
1 7.66467765 -0.7943559
|
|
2 3.75574227 -0.2318652
|
|
P 3
|
|
1 1.7589533 -0.4737399
|
|
2 0.78642667 -0.4833850
|
|
3 0.32120836 -0.1270103
|
|
P 1
|
|
1 34.98601375 1.0000000
|
|
P 1
|
|
1 15.94130814 1.0000000
|
|
P 1
|
|
1 0.04320618 1.0000000
|
|
D 6
|
|
1 472.56616866 0.0043589
|
|
2 137.31861329 0.0377691
|
|
3 49.86286764 0.1639483
|
|
4 20.18028062 0.3767715
|
|
5 8.58941274 0.4449457
|
|
6 3.7393933 0.2063615
|
|
D 1
|
|
1 1.50350395 1.0000000
|
|
D 1
|
|
1 0.55869489 1.0000000
|
|
D 1
|
|
1 0.18184595 1.0000000
|
|
F 1
|
|
1 1.61453202 1.0000000
|
|
F 1
|
|
1 0.48964913 1.0000000
|
|
G 1
|
|
1 1.25202413 1.0000000
|
|
|
|
PALLADIUM
|
|
S 9
|
|
1 16394098.88131892 0.0000450
|
|
2 2655217.51483467 0.0003048
|
|
3 678776.31228313 0.0013352
|
|
4 219665.80501989 0.0046805
|
|
5 81242.41475441 0.0145820
|
|
6 32967.5288186 0.0404820
|
|
7 14377.09197917 0.1052113
|
|
8 6473.94850062 0.2664154
|
|
9 2940.43362822 0.6453213
|
|
S 2
|
|
1 1330.28215143 0.3831136
|
|
2 596.99825278 0.6438200
|
|
S 2
|
|
1 55.39081866 -0.4292948
|
|
2 26.04547709 -0.5957261
|
|
S 2
|
|
1 10.42600533 0.3548073
|
|
2 5.28863687 0.6651963
|
|
S 1
|
|
1 268.59901681 1.0000000
|
|
S 1
|
|
1 119.64615224 1.0000000
|
|
S 1
|
|
1 2.29492553 1.0000000
|
|
S 1
|
|
1 1.10893497 1.0000000
|
|
S 1
|
|
1 0.45778304 1.0000000
|
|
P 8
|
|
1 22207.25359508 0.0002394
|
|
2 5471.41335116 0.0019071
|
|
3 1918.49567406 0.0088889
|
|
4 809.61512757 0.0313850
|
|
5 364.89914565 0.0989275
|
|
6 166.27815463 0.2525217
|
|
7 76.83458475 0.4192087
|
|
8 36.22989414 0.3428813
|
|
P 3
|
|
1 1.8308907 -0.4925092
|
|
2 0.81484159 -0.4689774
|
|
3 0.32778734 -0.1239069
|
|
P 1
|
|
1 16.4595431 1.0000000
|
|
P 1
|
|
1 7.91800554 1.0000000
|
|
P 1
|
|
1 3.87111672 1.0000000
|
|
P 1
|
|
1 0.075946835 1.0000000
|
|
D 6
|
|
1 468.32921888 0.0049597
|
|
2 136.08537428 0.0423407
|
|
3 49.37223726 0.1795203
|
|
4 19.90823127 0.3982008
|
|
5 8.41205724 0.4404064
|
|
6 3.5848421 0.1710971
|
|
D 1
|
|
1 1.44637137 1.0000000
|
|
D 1
|
|
1 0.52413985 1.0000000
|
|
D 1
|
|
1 0.16165741 1.0000000
|
|
F 1
|
|
1 1.63574112 1.0000000
|
|
F 1
|
|
1 0.48435811 1.0000000
|
|
G 1
|
|
1 1.35057114 1.0000000
|
|
|
|
SILVER
|
|
S 8
|
|
1 1933354.716231458 0.0002610
|
|
2 536064.929087191 0.0005506
|
|
3 227745.827779931 0.0020767
|
|
4 70738.083988609 0.0099739
|
|
5 24468.606984162 0.0298621
|
|
6 9167.058048276 0.1041579
|
|
7 3635.324478977 0.2491994
|
|
8 1492.625006356 0.6861292
|
|
S 2
|
|
1 626.659527641 0.4786072
|
|
2 266.573126951 0.5538807
|
|
S 2
|
|
1 106.496532758 0.0452748
|
|
2 50.521838397 0.9589238
|
|
S 3
|
|
1 1.714629191 -0.4330481
|
|
2 0.706057461 -0.5671712
|
|
3 0.257844322 -0.0442701
|
|
S 1
|
|
1 23.723095344 1.0000000
|
|
S 1
|
|
1 9.027326686 1.0000000
|
|
S 1
|
|
1 4.278042393 1.0000000
|
|
S 1
|
|
1 0.134801578 1.0000000
|
|
S 1
|
|
1 0.049271649 1.0000000
|
|
P 8
|
|
1 17107.148758796 0.0004035
|
|
2 4870.387177132 0.0018298
|
|
3 2407.146303535 0.0054191
|
|
4 987.063094024 0.0283682
|
|
5 403.451299303 0.1000111
|
|
6 177.672244805 0.2521395
|
|
7 82.251309333 0.4149138
|
|
8 39.082245155 0.3509970
|
|
P 3
|
|
1 17.887363062 0.2987454
|
|
2 8.467213162 0.5307062
|
|
3 4.006657577 0.2483106
|
|
P 1
|
|
1 1.897563027 1.0000000
|
|
P 1
|
|
1 0.821877632 1.0000000
|
|
P 1
|
|
1 0.303735793 1.0000000
|
|
P 1
|
|
1 0.0378678965 1.0000000
|
|
P 1
|
|
1 0.11473394825 1.0000000
|
|
D 6
|
|
1 501.383740114 0.0047154
|
|
2 151.394724553 0.0372484
|
|
3 57.551818465 0.1507206
|
|
4 24.361354900 0.3485936
|
|
5 10.696479542 0.4470369
|
|
6 4.745009329 0.2371497
|
|
D 1
|
|
1 1.937273588 1.0000000
|
|
D 1
|
|
1 0.729748582 1.0000000
|
|
D 1
|
|
1 0.237169881 1.0000000
|
|
F 1
|
|
1 2.0294120 1.0000000
|
|
F 1
|
|
1 0.6141945 1.0000000
|
|
G 1
|
|
1 1.6451630 1.0000000
|
|
|
|
CADMIUM
|
|
S 8
|
|
1 1834021.925799246 0.0002627
|
|
2 652410.438011762 0.0005409
|
|
3 196643.061551306 0.0031220
|
|
4 63597.001731472 0.0108340
|
|
5 24337.097220192 0.0308145
|
|
6 9430.018012690 0.1047587
|
|
7 3764.731995088 0.2614361
|
|
8 1567.578467961 0.6709190
|
|
S 2
|
|
1 669.389311313 0.4705744
|
|
2 289.981985771 0.5605305
|
|
S 2
|
|
1 123.421652251 0.0065755
|
|
2 55.415790285 0.9941469
|
|
S 2
|
|
1 10.538249763 0.3907911
|
|
2 5.316831595 0.6292946
|
|
S 2
|
|
1 0.841316152 0.7269330
|
|
2 0.321816396 0.3067736
|
|
S 1
|
|
1 25.639845178 1.0000000
|
|
S 1
|
|
1 1.656184464 1.0000000
|
|
S 1
|
|
1 0.143785579 1.0000000
|
|
S 1
|
|
1 0.048680186 1.0000000
|
|
P 8
|
|
1 16100.538573397 0.0004868
|
|
2 4077.294162925 0.0034697
|
|
3 1614.882168476 0.0110115
|
|
4 812.080304934 0.0304463
|
|
5 387.278771570 0.1011581
|
|
6 177.300362873 0.2586280
|
|
7 82.150981343 0.4195541
|
|
8 38.994293817 0.3317036
|
|
P 2
|
|
1 17.910833888 -0.4218396
|
|
2 8.509952142 -0.6179470
|
|
P 2
|
|
1 2.004202511 -0.5851014
|
|
2 0.999290497 -0.4506231
|
|
P 1
|
|
1 4.034099663 1.0000000
|
|
P 1
|
|
1 0.445731316 1.0000000
|
|
P 1
|
|
1 0.044865658 1.0000000
|
|
P 1
|
|
1 0.135521729 1.0000000
|
|
D 6
|
|
1 544.076274629 0.0043976
|
|
2 166.732896419 0.0342675
|
|
3 63.984534896 0.1404980
|
|
4 27.186326930 0.3375677
|
|
5 11.970318298 0.4491481
|
|
6 5.372281062 0.2548613
|
|
D 1
|
|
1 2.204454399 1.0000000
|
|
D 1
|
|
1 0.849288912 1.0000000
|
|
D 1
|
|
1 0.290103685 1.0000000
|
|
F 1
|
|
1 2.2673870 1.0000000
|
|
F 1
|
|
1 0.6891800 1.0000000
|
|
G 1
|
|
1 1.8094000 1.0000000
|
|
|
|
INDIUM
|
|
S 8
|
|
1 3911387.99396017 0.0001126
|
|
2 616287.73481971 0.0008020
|
|
3 151103.30117264 0.0037395
|
|
4 47141.85872853 0.0134119
|
|
5 17529.40640418 0.0387666
|
|
6 7260.52500212 0.1047107
|
|
7 3025.71991729 0.2841532
|
|
8 1247.90516632 0.6416536
|
|
S 2
|
|
1 525.78514244 -0.6182996
|
|
2 227.70274356 -0.4117580
|
|
S 2
|
|
1 37.42356574 0.8547280
|
|
2 15.40856655 0.1637561
|
|
S 2
|
|
1 7.80235647 -0.9129205
|
|
2 3.66651376 -0.0957109
|
|
S 2
|
|
1 1.58107676 0.6747568
|
|
2 0.68346506 0.3535450
|
|
S 1
|
|
1 81.15347986 1.0000000
|
|
S 1
|
|
1 0.16693398 1.0000000
|
|
S 1
|
|
1 0.06074596 1.0000000
|
|
S 1
|
|
1 0.03037298 1.0000000
|
|
P 7
|
|
1 15057.43809137 0.0005984
|
|
2 3736.13730897 0.0046182
|
|
3 1305.52437933 0.0215333
|
|
4 530.19961571 0.0783546
|
|
5 227.22714039 0.2267649
|
|
6 100.29531263 0.4265742
|
|
7 45.55071966 0.3928273
|
|
P 2
|
|
1 9.30536768 -0.7319368
|
|
2 4.34502689 -0.3034736
|
|
P 3
|
|
1 2.03496374 0.6922614
|
|
2 0.89930195 0.3509367
|
|
3 0.04072711 0.0068795
|
|
P 1
|
|
1 19.89039293 1.0000000
|
|
P 1
|
|
1 0.34908476 1.0000000
|
|
P 1
|
|
1 0.11984145 1.0000000
|
|
P 1
|
|
1 0.059920725 1.0000000
|
|
D 6
|
|
1 404.44497713 0.0091116
|
|
2 120.40150512 0.0674912
|
|
3 44.84756662 0.2438020
|
|
4 18.32709234 0.4522366
|
|
5 7.76910230 0.3830643
|
|
6 3.02700765 0.0825163
|
|
D 1
|
|
1 1.17153703 1.0000000
|
|
D 1
|
|
1 0.40449780 1.0000000
|
|
D 1
|
|
1 0.2022489 1.0000000
|
|
F 1
|
|
1 2.5757900 1.0000000
|
|
F 1
|
|
1 0.8041010 1.0000000
|
|
G 1
|
|
1 2.0399300 1.0000000
|
|
|
|
TIN
|
|
S 8
|
|
1 4238589.38529473 0.0001263
|
|
2 673793.42495089 0.0008800
|
|
3 170097.07647820 0.0038795
|
|
4 55609.70461290 0.0129455
|
|
5 21415.49971415 0.0369050
|
|
6 8977.66375890 0.0996500
|
|
7 3782.07819166 0.2737153
|
|
8 1562.92528277 0.6563110
|
|
S 2
|
|
1 648.12338474 -0.5701632
|
|
2 272.54080122 -0.4629734
|
|
S 2
|
|
1 46.76879883 -0.7902759
|
|
2 22.69311379 -0.2259347
|
|
S 2
|
|
1 9.71239974 -0.6399296
|
|
2 4.80098504 -0.3811111
|
|
S 2
|
|
1 1.87390748 0.6068691
|
|
2 0.82932636 0.4219649
|
|
S 1
|
|
1 94.87261510 1.0000000
|
|
S 1
|
|
1 0.20078915 1.0000000
|
|
S 1
|
|
1 0.07538279 1.0000000
|
|
S 1
|
|
1 0.037691395 1.0000000
|
|
P 7
|
|
1 15934.47942881 0.0005873
|
|
2 3949.03996243 0.0045455
|
|
3 1382.89878270 0.0210093
|
|
4 566.21188582 0.0755028
|
|
5 244.15478655 0.2202092
|
|
6 107.89717825 0.4237674
|
|
7 48.96252198 0.4038944
|
|
P 2
|
|
1 10.07938092 0.7252962
|
|
2 4.75501791 0.3096567
|
|
P 3
|
|
1 2.25355772 0.6755163
|
|
2 1.01299742 0.3734322
|
|
3 0.15319025 -0.0228824
|
|
P 1
|
|
1 21.42982885 1.0000000
|
|
P 1
|
|
1 0.39772444 1.0000000
|
|
P 1
|
|
1 0.05502644 1.0000000
|
|
P 1
|
|
1 0.02751322 1.0000000
|
|
D 6
|
|
1 439.54036499 0.0085018
|
|
2 130.83523828 0.0639522
|
|
3 48.78644670 0.2353001
|
|
4 20.01140691 0.4465600
|
|
5 8.53464202 0.3913098
|
|
6 3.38957135 0.0903839
|
|
D 1
|
|
1 1.34061058 1.0000000
|
|
D 1
|
|
1 0.47738533 1.0000000
|
|
D 1
|
|
1 0.238692665 1.0000000
|
|
F 1
|
|
1 2.9418900 1.0000000
|
|
F 1
|
|
1 0.9448905 1.0000000
|
|
G 1
|
|
1 2.3025000 1.0000000
|
|
|
|
ANTIMONY
|
|
S 7
|
|
1 5582873.0153224 0.0003159
|
|
2 879632.17826077 0.0021104
|
|
3 219858.53695954 0.0103324
|
|
4 71510.44516702 0.0299360
|
|
5 27203.56806901 0.1079980
|
|
6 11415.28340729 0.2146967
|
|
7 5056.98602308 0.7090303
|
|
S 2
|
|
1 2212.07133111 0.3240462
|
|
2 954.45988652 0.7031085
|
|
S 2
|
|
1 420.42821589 0.7093170
|
|
2 192.1828529 0.3140283
|
|
S 2
|
|
1 77.80880844 0.3694770
|
|
2 35.70705937 0.6556563
|
|
S 2
|
|
1 14.34975064 0.1821076
|
|
2 7.16562186 0.8306451
|
|
S 2
|
|
1 3.1654841 -0.1676009
|
|
2 1.56291467 -0.8447044
|
|
S 1
|
|
1 0.7447576 1.0000000
|
|
S 1
|
|
1 0.22945256 1.0000000
|
|
S 1
|
|
1 0.08699455 1.0000000
|
|
P 8
|
|
1 26055.67624579 0.0002598
|
|
2 6389.07887714 0.0020864
|
|
3 2239.11857256 0.0096487
|
|
4 946.84224212 0.0340598
|
|
5 422.77056503 0.1093677
|
|
6 190.04772117 0.2753722
|
|
7 87.15850447 0.4266667
|
|
8 41.0051232 0.3029978
|
|
P 2
|
|
1 18.46825096 0.5349053
|
|
2 8.86338104 0.5053475
|
|
P 2
|
|
1 2.03231699 0.7064501
|
|
2 0.96460687 0.3292083
|
|
P 1
|
|
1 4.10560297 1.0000000
|
|
P 1
|
|
1 0.39250261 1.0000000
|
|
P 1
|
|
1 0.16506433 1.0000000
|
|
P 1
|
|
1 0.06393081 1.0000000
|
|
D 7
|
|
1 850.86641522 0.0023310
|
|
2 256.13437409 0.0204763
|
|
3 96.44163194 0.0984059
|
|
4 40.09512809 0.2830268
|
|
5 17.44203029 0.4478942
|
|
6 7.80934835 0.3201314
|
|
7 3.27256056 0.0615441
|
|
D 1
|
|
1 1.33882083 1.0000000
|
|
D 1
|
|
1 0.49916163 1.0000000
|
|
D 1
|
|
1 0.249580815 1.0000000
|
|
F 1
|
|
1 3.24496442 1.0000000
|
|
F 1
|
|
1 1.05774061 1.0000000
|
|
G 1
|
|
1 2.49959355 1.0000000
|
|
|
|
TELLURIUM
|
|
S 8
|
|
1 4650601.62944046 -0.0001291
|
|
2 732410.37796376 -0.0009121
|
|
3 183587.78336399 -0.0040438
|
|
4 60119.30754396 -0.0133655
|
|
5 23190.68448638 -0.0383029
|
|
6 9737.01632783 -0.1018466
|
|
7 4166.07002735 -0.2725802
|
|
8 1748.29117439 -0.6528605
|
|
S 2
|
|
1 729.63641733 -0.5576433
|
|
2 307.46500803 -0.4754956
|
|
S 2
|
|
1 55.97521174 -0.7379376
|
|
2 27.54602392 -0.2801360
|
|
S 2
|
|
1 11.33873168 -0.5486633
|
|
2 5.70208693 -0.4726956
|
|
S 2
|
|
1 2.22186025 0.5734969
|
|
2 1.02667130 0.4530005
|
|
S 1
|
|
1 110.73724148 1.0000000
|
|
S 1
|
|
1 0.27246346 1.0000000
|
|
S 1
|
|
1 0.10489073 1.0000000
|
|
S 1
|
|
1 0.052445365 1.0000000
|
|
P 7
|
|
1 8289.94492999 0.0005423
|
|
2 4521.61764712 0.0042249
|
|
3 1585.75140286 0.0194377
|
|
4 654.35415772 0.0694895
|
|
5 283.76216310 0.2069498
|
|
6 125.50601977 0.4171248
|
|
7 56.92437628 0.4276298
|
|
P 2
|
|
1 11.96243933 -0.7083409
|
|
2 5.74608357 -0.3260789
|
|
P 3
|
|
1 2.71079969 0.5979879
|
|
2 1.23555585 0.3895349
|
|
3 0.47667416 0.0876738
|
|
P 1
|
|
1 25.23465437 1.0000000
|
|
P 1
|
|
1 0.19817871 1.0000000
|
|
P 1
|
|
1 0.07356233 1.0000000
|
|
P 1
|
|
1 0.036781165 1.0000000
|
|
D 6
|
|
1 519.00405018 0.0073211
|
|
2 155.37108353 0.0560993
|
|
3 58.31953191 0.2142426
|
|
4 24.11039580 0.4317449
|
|
5 10.36130878 0.4124570
|
|
6 4.22870886 0.1097825
|
|
D 1
|
|
1 1.72518271 1.0000000
|
|
D 1
|
|
1 0.63881217 1.0000000
|
|
D 1
|
|
1 0.319406085 1.0000000
|
|
F 1
|
|
1 3.5301500 1.0000000
|
|
F 1
|
|
1 1.1549950 1.0000000
|
|
G 1
|
|
1 2.7535500 1.0000000
|
|
|
|
IODINE
|
|
S 8
|
|
1 5464702.08060097 0.0001093
|
|
2 849942.52168504 0.0007913
|
|
3 207458.86762606 0.0036900
|
|
4 64929.86485391 0.0131833
|
|
5 23909.80880875 0.0395406
|
|
6 9850.71275593 0.1040723
|
|
7 4222.34623514 0.2741166
|
|
8 1781.76403452 0.6488818
|
|
S 2
|
|
1 749.21394356 -0.5595941
|
|
2 318.75246448 -0.4728234
|
|
S 2
|
|
1 59.88344918 -0.7200351
|
|
2 29.50227605 -0.2987074
|
|
S 2
|
|
1 12.24593624 -0.5061450
|
|
2 6.20345391 -0.5148945
|
|
S 2
|
|
1 2.43764323 0.5412411
|
|
2 1.14985168 0.4841938
|
|
S 1
|
|
1 118.02205930 1.0000000
|
|
S 1
|
|
1 0.30638210 1.0000000
|
|
S 1
|
|
1 0.11926836 1.0000000
|
|
S 1
|
|
1 0.05963418 1.0000000
|
|
P 7
|
|
1 20182.20166081 0.0004988
|
|
2 4999.21100888 0.0038641
|
|
3 1768.53795847 0.0174910
|
|
4 734.77528080 0.0632147
|
|
5 317.51165410 0.1951982
|
|
6 139.60118455 0.4117047
|
|
7 63.12833732 0.4496355
|
|
P 2
|
|
1 13.45203045 -0.6861431
|
|
2 6.52579989 -0.3486363
|
|
P 3
|
|
1 3.02467901 0.5601269
|
|
2 1.38040546 0.4313665
|
|
3 0.52669045 0.0821826
|
|
P 1
|
|
1 28.34086632 1.0000000
|
|
P 1
|
|
1 0.22217820 1.0000000
|
|
P 1
|
|
1 0.08328104 1.0000000
|
|
P 1
|
|
1 0.04164052 1.0000000
|
|
D 6
|
|
1 565.98837950 0.0067496
|
|
2 168.69681731 0.0529920
|
|
3 63.14306896 0.2071444
|
|
4 26.10306850 0.4270744
|
|
5 11.24530421 0.4189456
|
|
6 4.63907320 0.1167256
|
|
D 1
|
|
1 1.91572411 1.0000000
|
|
D 1
|
|
1 0.72024616 1.0000000
|
|
D 1
|
|
1 0.36012308 1.0000000
|
|
F 1
|
|
1 3.85297909 1.0000000
|
|
F 1
|
|
1 1.265860195 1.0000000
|
|
G 1
|
|
1 2.97888999 1.0000000
|
|
|
|
XENON
|
|
S 8
|
|
1 5300603.64553030 0.0001206
|
|
2 830291.96023362 0.0008636
|
|
3 204622.59537664 0.0039494
|
|
4 65467.65670800 0.0135309
|
|
5 24638.35965707 0.0400564
|
|
6 10166.62174430 0.1067087
|
|
7 4378.44248334 0.2749072
|
|
8 1872.44267126 0.6441580
|
|
S 2
|
|
1 791.67226166 -0.5534700
|
|
2 335.97247692 -0.4791942
|
|
S 2
|
|
1 62.71741001 -0.7187354
|
|
2 30.85802860 -0.3001261
|
|
S 2
|
|
1 12.58441890 -0.5299055
|
|
2 6.37253749 -0.4911267
|
|
S 2
|
|
1 2.52103894 0.5795385
|
|
2 1.19813268 0.4450428
|
|
S 1
|
|
1 123.77865014 1.0000000
|
|
S 1
|
|
1 0.35467594 1.0000000
|
|
S 1
|
|
1 0.13770054 1.0000000
|
|
S 1
|
|
1 0.06885027 1.0000000
|
|
P 7
|
|
1 19789.21536178 0.0005471
|
|
2 4884.31861520 0.0042796
|
|
3 1716.21072091 0.0194546
|
|
4 717.46791924 0.0675559
|
|
5 315.32662293 0.2005936
|
|
6 140.29749882 0.4126803
|
|
7 63.76419492 0.4381311
|
|
P 2
|
|
1 13.53639555 -0.7044975
|
|
2 6.53430209 -0.3297007
|
|
P 3
|
|
1 3.09312426 0.6028430
|
|
2 1.44315313 0.3816860
|
|
3 0.57854424 0.0860834
|
|
P 1
|
|
1 28.46523338 1.0000000
|
|
P 1
|
|
1 0.24632510 1.0000000
|
|
P 1
|
|
1 0.09406752 1.0000000
|
|
P 1
|
|
1 0.04703376 1.0000000
|
|
D 6
|
|
1 562.16186208 0.0075383
|
|
2 166.96897515 0.0586387
|
|
3 62.58995927 0.2216933
|
|
4 26.06667973 0.4340414
|
|
5 11.40476322 0.3998265
|
|
6 4.80680923 0.1061374
|
|
D 1
|
|
1 2.02133549 1.0000000
|
|
D 1
|
|
1 0.77586645 1.0000000
|
|
D 1
|
|
1 0.387933225 1.0000000
|
|
F 1
|
|
1 4.02822969 1.0000000
|
|
F 1
|
|
1 1.305589995 1.0000000
|
|
G 1
|
|
1 3.24381999 1.0000000
|
|
|
|
|