PTEROSOR/QuantumPackage
10
0
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-25 13:53:43 +01:00
Code Releases Activity
f133cb1e9f
QuantumPackage/data/basis/aug-qzp
Anthony Scemama 24d9745056 Initial commit
2019-01-25 11:39:31 +01:00

3998 lines
125 KiB
Plaintext
Raw Blame History

HYDROGEN
S 3
1 114.56539174 0.0013352
2 17.14344486 0.0103806
3 3.80423282 0.0548548
S 1
1 1.03752199 1.0000000
S 1
1 0.32994305 1.0000000
S 1
1 0.1138142 1.0000000
S 1
1 0.02756672 1.0000000
P 1
1 2.8035900 1.0000000
P 1
1 0.8816880 1.0000000
P 1
1 0.2997440 1.0000000
P 1
1 0.0810793 1.0000000
D 1
1 1.9234900 1.0000000
D 1
1 0.6294740 1.0000000
D 1
1 0.1649830 1.0000000
F 1
1 1.48884099 1.0000000
F 1
1 0.3197780 1.0000000
LITHIUM
S 5
1 5400.68589735 0.0017221
2 861.76754308 0.0118608
3 218.61101955 0.0525297
4 66.57415634 0.2109626
5 21.07384786 0.7932125
S 2
1 6.93471434 0.3563834
2 2.42448822 0.6866889
S 1
1 0.91838674 1.0000000
S 1
1 0.3745421 1.0000000
S 1
1 0.07807489 1.0000000
S 1
1 0.02902125 1.0000000
S 1
1 0.01044448 1.0000000
P 4
1 9.48147600 0.0135752
2 2.24036769 0.0773522
3 0.71593636 0.2280041
4 0.26271171 0.7837819
P 1
1 0.09640165 1.0000000
P 1
1 0.03847656 1.0000000
P 1
1 0.01626165 1.0000000
P 1
1 0.00813083 1.0000000
D 1
1 0.309486848 1.0000000
D 1
1 0.102256236 1.0000000
D 1
1 0.038628947 1.0000000
D 1
1 0.018107474 1.0000000
F 1
1 0.276855839 1.0000000
F 1
1 0.107900255 1.0000000
F 1
1 0.040783255 1.0000000
G 1
1 0.155799709 1.0000000
G 1
1 0.061826709 1.0000000
BERYLLIUM
S 5
1 11081.84641376 -0.0016033
2 1775.8270006 -0.0110258
3 444.55456321 -0.0506732
4 131.90745386 -0.2103994
5 41.3628268 -0.7960492
S 2
1 13.71566977 0.3478461
2 4.88023308 0.6934175
S 1
1 1.88889812 1.0000000
S 1
1 0.78023196 1.0000000
S 1
1 0.18460998 1.0000000
S 1
1 0.06504246 1.0000000
S 1
1 0.019426908 1.0000000
P 4
1 31.7623146 0.0078552
2 7.63693323 0.0545525
3 2.3635483 0.2259386
4 0.79269124 0.8060020
P 1
1 0.28748284 1.0000000
P 1
1 0.11074806 1.0000000
P 1
1 0.04282454 1.0000000
P 1
1 0.012882804 1.0000000
D 1
1 0.6973400 1.0000000
D 1
1 0.2189170 1.0000000
D 1
1 0.0788820 1.0000000
D 1
1 0.045120696 1.0000000
F 1
1 0.5352400 1.0000000
F 1
1 0.1742800 1.0000000
F 1
1 0.085597291 1.0000000
G 1
1 0.3584300 1.0000000
G 1
1 0.160452999 1.0000000
BORON
S 6
1 15057.32106066 0.0005205
2 2403.4479364 0.0036225
3 592.38550429 0.0170494
4 174.58558028 0.0699477
5 55.4370468 0.2550483
6 18.6183777 0.7350790
S 1
1 6.57248264 1.0000000
S 1
1 2.3847007 1.0000000
S 1
1 0.66203798 1.0000000
S 1
1 0.27360058 1.0000000
S 1
1 0.09340695 1.0000000
S 1
1 0.0300377 1.0000000
P 4
1 52.72558406 0.0067418
2 12.32811662 0.0510250
3 3.71542201 0.2319718
4 1.25220134 0.8025493
P 1
1 0.49382848 1.0000000
P 1
1 0.2001563 1.0000000
P 1
1 0.07143279 1.0000000
P 1
1 0.0165610 1.0000000
D 1
1 1.01688333 1.0000000
D 1
1 0.68549992 1.0000000
D 1
1 0.43925666 1.0000000
D 1
1 0.17108833 1.0000000
F 1
1 1.0648210 1.0000000
F 1
1 0.8942600 1.0000000
F 1
1 0.3463210 1.0000000
G 1
1 1.0649010 1.0000000
G 1
1 0.6545510 1.0000000
CARBON
S 6
1 25535.64100566 0.0004256
2 3874.88563411 0.0032401
3 889.83914982 0.0168330
4 249.53489613 0.0715124
5 78.37665196 0.2573716
6 26.52461695 0.7319293
S 1
1 9.46481133 1.0000000
S 1
1 3.45700753 1.0000000
S 1
1 0.92203194 1.0000000
S 1
1 0.38287565 1.0000000
S 1
1 0.13146357 1.0000000
S 1
1 0.0429200 1.0000000
P 4
1 79.21495996 0.0065854
2 18.37494849 0.0516107
3 5.55857744 0.2393343
4 1.9048429 0.7944030
P 1
1 0.73145146 1.0000000
P 1
1 0.28576367 1.0000000
P 1
1 0.10155377 1.0000000
P 1
1 0.0321550 1.0000000
D 1
1 1.74162666 1.0000000
D 1
1 0.68952943 1.0000000
D 1
1 0.25867476 1.0000000
D 1
1 0.11964894 1.0000000
F 1
1 1.4058000 1.0000000
F 1
1 0.5166510 1.0000000
F 1
1 0.21051009 1.0000000
G 1
1 1.0134700 1.0000000
G 1
1 0.4320070 1.0000000
NITROGEN
S 6
1 33756.09280183 0.0004414
2 5171.54456387 0.0033069
3 1201.58270859 0.0169104
4 339.89996302 0.0713258
5 107.18829283 0.2566492
6 36.34285747 0.7324220
S 1
1 13.0124189 1.0000000
S 1
1 4.76935355 1.0000000
S 1
1 1.26608685 1.0000000
S 1
1 0.51561424 1.0000000
S 1
1 0.17548216 1.0000000
S 1
1 0.0509600 1.0000000
P 4
1 111.36093291 0.0064572
2 25.79833493 0.0515731
3 7.82929062 0.2430571
4 2.70129304 0.7905273
P 1
1 1.02623864 1.0000000
P 1
1 0.39312803 1.0000000
P 1
1 0.13795767 1.0000000
P 1
1 0.0389010 1.0000000
D 1
1 2.6737200 1.0000000
D 1
1 1.0050355 1.0000000
D 1
1 0.3660760 1.0000000
D 1
1 0.12049776 1.0000000
F 1
1 2.0306010 1.0000000
F 1
1 0.7213290 1.0000000
F 1
1 0.28861446 1.0000000
G 1
1 1.4543700 1.0000000
G 1
1 0.5949019 1.0000000
OXYGEN
S 6
1 44147.8322946 0.0004417
2 6765.02954553 0.0033083
3 1572.27028683 0.0169086
4 444.9790091 0.0712924
5 140.4452637 0.2564407
6 47.69826313 0.7324930
S 1
1 17.15907213 1.0000000
S 1
1 6.33918778 1.0000000
S 1
1 1.74427248 1.0000000
S 1
1 0.70880065 1.0000000
S 1
1 0.23992974 1.0000000
S 1
1 0.0681800 1.0000000
P 4
1 137.95232259 0.0066831
2 31.96710724 0.0534136
3 9.73144594 0.2509601
4 3.3775634 0.7822321
P 1
1 1.27008334 1.0000000
P 1
1 0.47167423 1.0000000
P 1
1 0.15927889 1.0000000
P 1
1 0.0483890 1.0000000
D 1
1 3.78520234 1.0000000
D 1
1 1.36599065 1.0000000
D 1
1 0.47681133 1.0000000
D 1
1 0.1631610 1.0000000
F 1
1 2.6656900 1.0000000
F 1
1 0.88935698 1.0000000
F 1
1 0.3436600 1.0000000
G 1
1 1.91794008 1.0000000
G 1
1 0.73334808 1.0000000
FLUORINE
S 6
1 55735.95982409 0.0004422
2 8543.68079426 0.0033115
3 1985.63391851 0.0169275
4 561.92926801 0.0713861
5 177.44305676 0.2565714
6 60.3602286 0.7321740
S 1
1 21.79266972 1.0000000
S 1
1 8.08688312 1.0000000
S 1
1 2.24808494 1.0000000
S 1
1 0.9099084 1.0000000
S 1
1 0.30780163 1.0000000
S 1
1 0.0856300 1.0000000
P 4
1 170.24080575 0.0068732
2 39.45428961 0.0550643
3 12.05744104 0.2575174
4 4.21340179 0.7750166
P 1
1 1.58432336 1.0000000
P 1
1 0.58444536 1.0000000
P 1
1 0.19493884 1.0000000
P 1
1 0.0600530 1.0000000
D 1
1 4.59567366 1.0000000
D 1
1 1.63825833 1.0000000
D 1
1 0.57420786 1.0000000
D 1
1 0.2022000 1.0000000
F 1
1 3.5548300 1.0000000
F 1
1 1.1778600 1.0000000
F 1
1 0.4789100 1.0000000
G 1
1 2.4584300 1.0000000
G 1
1 0.9417270 1.0000000
NEON
S 6
1 69922.03113438 0.0004323
2 10640.81399898 0.0032769
3 2452.06599575 0.0169343
4 690.22655546 0.0716747
5 217.74966925 0.2571169
6 74.20647896 0.7313902
S 1
1 26.89151172 1.0000000
S 1
1 10.01978382 1.0000000
S 1
1 2.80619223 1.0000000
S 1
1 1.13103641 1.0000000
S 1
1 0.38188932 1.0000000
S 1
1 0.102883176 1.0000000
P 4
1 207.15692607 0.0070250
2 48.08163921 0.0563029
3 14.75885757 0.2620021
4 5.18464792 0.7698918
P 1
1 1.96025404 1.0000000
P 1
1 0.7252328 1.0000000
P 1
1 0.23949343 1.0000000
P 1
1 0.071091861 1.0000000
D 1
1 6.4350000 1.0000000
D 1
1 2.2404209 1.0000000
D 1
1 0.7596000 1.0000000
D 1
1 0.226455445 1.0000000
F 1
1 4.5896400 1.0000000
F 1
1 1.5282100 1.0000000
F 1
1 0.581370158 1.0000000
G 1
1 3.1008000 1.0000000
G 1
1 1.1089115 1.0000000
SODIUM
S 5
1 94871.60121392 0.0015373
2 14615.65270614 0.0112932
3 3517.76343517 0.0539595
4 1045.84926241 0.2156446
5 338.64237449 0.7873777
S 2
1 115.75803273 0.3370570
2 42.2076173 0.7017991
S 1
1 16.50521544 1.0000000
S 1
1 6.74292301 1.0000000
S 1
1 2.33018444 1.0000000
S 1
1 0.8937335 1.0000000
S 1
1 0.3567372 1.0000000
S 1
1 0.06665744 1.0000000
S 1
1 0.0258154 1.0000000
S 1
1 0.0108854 1.0000000
P 6
1 250.18984258 0.0024206
2 66.48657184 0.0138066
3 24.11466110 0.0579898
4 8.74638087 0.2001814
5 3.25151161 0.4136569
6 1.20153511 0.4948622
P 1
1 0.44400476 1.0000000
P 1
1 0.16407363 1.0000000
P 1
1 0.06063033 1.0000000
P 1
1 0.02240480 1.0000000
P 1
1 0.00827927 1.0000000
D 1
1 0.048255925 1.0000000
D 1
1 0.200945227 1.0000000
D 1
1 0.110008852 1.0000000
D 1
1 0.018526852 1.0000000
F 1
1 0.103407613 1.0000000
F 1
1 0.224661281 1.0000000
F 1
1 0.037771281 1.0000000
G 1
1 0.202805758 1.0000000
G 1
1 0.067575758 1.0000000
MAGNESIUM
S 5
1 99758.47868406 0.0015680
2 15044.04010697 0.0119420
3 3533.33105973 0.0585833
4 1050.67827966 0.2262241
5 351.24641765 0.7728391
S 2
1 124.33167843 0.3471784
2 46.39572169 0.6906535
S 1
1 18.98728849 1.0000000
S 1
1 8.70232478 1.0000000
S 1
1 2.74436367 1.0000000
S 1
1 1.13837086 1.0000000
S 1
1 0.50105589 1.0000000
S 1
1 0.12411409 1.0000000
S 1
1 0.04722861 1.0000000
S 1
1 0.0092300 1.0000000
P 6
1 414.77813103 0.0015549
2 97.44433577 0.0128608
3 30.32893988 0.0639317
4 10.83260082 0.2078216
5 4.18472237 0.4090570
6 1.67223816 0.4771238
P 1
1 0.68434651 1.0000000
P 1
1 0.25072067 1.0000000
P 1
1 0.10184345 1.0000000
P 1
1 0.04374543 1.0000000
P 1
1 0.01948153 1.0000000
P 1
1 0.006870586 1.0000000
D 1
1 0.5024100 1.0000000
D 1
1 0.1647570 1.0000000
D 1
1 0.0598300 1.0000000
D 1
1 0.018410172 1.0000000
F 1
1 0.4164400 1.0000000
F 1
1 0.1324800 1.0000000
F 1
1 0.048682165 1.0000000
G 1
1 0.1890200 1.0000000
G 1
1 0.053807588 1.0000000
ALUMINUM
S 5
1 129723.40900444 0.0015810
2 19397.04720580 0.0121835
3 4541.96673087 0.0596522
4 1362.39472818 0.2263338
5 460.80165540 0.7711056
S 2
1 164.04277276 0.3363559
2 61.46095883 0.7005726
S 1
1 25.10631046 1.0000000
S 1
1 11.10418729 1.0000000
S 1
1 3.50832056 1.0000000
S 1
1 1.44700068 1.0000000
S 1
1 0.60811909 1.0000000
S 1
1 0.18874525 1.0000000
S 1
1 0.06784606 1.0000000
S 1
1 0.02225606 1.0000000
P 6
1 824.44683347 0.0008709
2 202.13338555 0.0068778
3 66.36414466 0.0350874
4 24.37031175 0.1350210
5 9.5677739 0.3593883
6 3.91352352 0.5947089
P 1
1 1.65302834 1.0000000
P 1
1 0.71264131 1.0000000
P 1
1 0.2644241 1.0000000
P 1
1 0.10595955 1.0000000
P 1
1 0.04050719 1.0000000
P 1
1 0.01231919 1.0000000
D 1
1 0.09172533 1.0000000
D 1
1 0.42866666 1.0000000
D 1
1 0.22371833 1.0000000
D 1
1 0.03035833 1.0000000
F 1
1 0.1862700 1.0000000
F 1
1 0.4278130 1.0000000
F 1
1 0.0741630 1.0000000
G 1
1 0.3491410 1.0000000
G 1
1 0.1604310 1.0000000
SILICON
S 5
1 176215.85131732 0.0015152
2 26471.54218954 0.0116249
3 6189.54811648 0.0573734
4 1840.70550356 0.2221817
5 614.59391512 0.7774185
S 2
1 216.24863788 0.3251876
2 80.41523061 0.7115678
S 1
1 32.55756321 1.0000000
S 1
1 14.04922152 1.0000000
S 1
1 4.33057743 1.0000000
S 1
1 1.77883439 1.0000000
S 1
1 0.70737463 1.0000000
S 1
1 0.25842697 1.0000000
S 1
1 0.09247057 1.0000000
S 1
1 0.03138057 1.0000000
P 6
1 1218.53846759 0.0006372
2 288.65048248 0.0054985
3 91.44147264 0.0305221
4 32.81428319 0.1245040
5 12.75117034 0.3505219
6 5.21459776 0.6138017
P 1
1 2.21559758 1.0000000
P 1
1 0.96491358 1.0000000
P 1
1 0.3669534 1.0000000
P 1
1 0.14805353 1.0000000
P 1
1 0.05707829 1.0000000
P 1
1 0.02000829 1.0000000
D 1
1 0.12374666 1.0000000
D 1
1 0.59450943 1.0000000
D 1
1 0.29245476 1.0000000
D 1
1 0.01021839 1.0000000
F 1
1 0.2433000 1.0000000
F 1
1 0.5697110 1.0000000
F 1
1 0.1202640 1.0000000
G 1
1 0.4711000 1.0000000
G 1
1 0.2694108 1.0000000
PHOSPHORUS
S 5
1 216397.82570244 0.0015417
2 32605.09292044 0.0117613
3 7664.82500246 0.0575834
4 2292.34193943 0.2218063
5 768.48785783 0.7772213
S 2
1 271.09457271 0.3181584
2 100.98096019 0.7180301
S 1
1 40.75736396 1.0000000
S 1
1 17.35136514 1.0000000
S 1
1 5.43733275 1.0000000
S 1
1 2.30628191 1.0000000
S 1
1 0.9635101 1.0000000
S 1
1 0.33645843 1.0000000
S 1
1 0.11990735 1.0000000
S 1
1 0.03807735 1.0000000
P 6
1 1518.52178977 0.0005913
2 360.67435609 0.0050906
3 114.82705423 0.0283978
4 41.35375021 0.1180151
5 16.09695729 0.3433266
6 6.60240268 0.6257261
P 1
1 2.82105739 1.0000000
P 1
1 1.23910355 1.0000000
P 1
1 0.48066204 1.0000000
P 1
1 0.19554441 1.0000000
P 1
1 0.07581816 1.0000000
P 1
1 0.02482816 1.0000000
D 1
1 0.1628400 1.0000000
D 1
1 0.8042855 1.0000000
D 1
1 0.3813160 1.0000000
D 1
1 0.0594300 1.0000000
F 1
1 0.3097010 1.0000000
F 1
1 0.7321790 1.0000000
F 1
1 0.1268890 1.0000000
G 1
1 0.6130300 1.0000000
G 1
1 0.2649300 1.0000000
SULFUR
S 5
1 251373.75793279 0.0015480
2 37750.6355577 0.0119029
3 8806.11787722 0.0589017
4 2632.06692716 0.2246463
5 892.12673946 0.7731061
S 2
1 317.6990552 0.3152181
2 118.71899897 0.7205651
S 1
1 47.94957659 1.0000000
S 1
1 20.3758607 1.0000000
S 1
1 6.34052137 1.0000000
S 1
1 2.69750286 1.0000000
S 1
1 1.08901911 1.0000000
S 1
1 0.41903188 1.0000000
S 1
1 0.14944546 1.0000000
S 1
1 0.04654546 1.0000000
P 6
1 1752.78185715 0.0005807
2 415.54966952 0.0050304
3 131.98874869 0.0282621
4 47.49200543 0.1180568
5 18.48687604 0.3439220
6 7.5838037 0.6251513
P 1
1 3.24902393 1.0000000
P 1
1 1.42952715 1.0000000
P 1
1 0.56994531 1.0000000
P 1
1 0.22914489 1.0000000
P 1
1 0.0870482 1.0000000
P 1
1 0.0303282 1.0000000
D 1
1 0.20509134 1.0000000
D 1
1 1.06622065 1.0000000
D 1
1 0.49257133 1.0000000
D 1
1 0.07703233 1.0000000
F 1
1 0.3542700 1.0000000
F 1
1 0.88266698 1.0000000
F 1
1 0.15957707 1.0000000
G 1
1 0.72606508 1.0000000
G 1
1 0.33104508 1.0000000
CHLORINE
S 5
1 348885.0892878 0.0015623
2 51762.31967393 0.0122351
3 11985.50127725 0.0607094
4 3621.61633403 0.2251665
5 1250.4688675 0.7700413
S 2
1 446.07229006 0.2962773
2 164.50216681 0.7390452
S 1
1 64.59549732 1.0000000
S 1
1 26.32972522 1.0000000
S 1
1 7.99425281 1.0000000
S 1
1 3.53388994 1.0000000
S 1
1 1.53242757 1.0000000
S 1
1 0.52713802 1.0000000
S 1
1 0.18659624 1.0000000
S 1
1 0.05630624 1.0000000
P 6
1 1960.85895168 0.0006290
2 481.90436441 0.0049989
3 160.82751993 0.0260265
4 59.67490074 0.1086202
5 23.39844061 0.3319893
6 9.57633625 0.6437093
P 1
1 4.07948443 1.0000000
P 1
1 1.7869803 1.0000000
P 1
1 0.70946527 1.0000000
P 1
1 0.28222949 1.0000000
P 1
1 0.1060451 1.0000000
P 1
1 0.0374451 1.0000000
D 1
1 0.25192866 1.0000000
D 1
1 1.34771833 1.0000000
D 1
1 0.60989786 1.0000000
D 1
1 0.09607786 1.0000000
F 1
1 0.4411500 1.0000000
F 1
1 1.0879700 1.0000000
F 1
1 0.2181600 1.0000000
G 1
1 0.8800600 1.0000000
G 1
1 0.4144600 1.0000000
ARGON
S 5
1 360155.04628199 0.0013854
2 53234.97836023 0.0109253
3 12153.55013735 0.0560629
4 3527.65070309 0.2233198
5 1170.50751168 0.7782147
S 2
1 416.43997303 0.3146907
2 157.03913416 0.7204578
S 1
1 63.67185956 1.0000000
S 1
1 26.90726266 1.0000000
S 1
1 8.59253091 1.0000000
S 1
1 3.75985178 1.0000000
S 1
1 1.54584954 1.0000000
S 1
1 0.60135631 1.0000000
S 1
1 0.21306255 1.0000000
S 1
1 0.0431300 1.0000000
P 6
1 1610.4219968 0.0009635
2 394.24553061 0.0076010
3 132.3929622 0.0370052
4 50.8773657 0.1348929
5 20.92775754 0.3527645
6 8.92655737 0.5918487
P 1
1 3.94047465 1.0000000
P 1
1 1.78904991 1.0000000
P 1
1 0.72894503 1.0000000
P 1
1 0.30009745 1.0000000
P 1
1 0.11603048 1.0000000
P 1
1 0.043770723 1.0000000
D 1
1 0.2932810 1.0000000
D 1
1 1.7374409 1.0000000
D 1
1 0.7464200 1.0000000
D 1
1 0.117280139 1.0000000
F 1
1 0.5957400 1.0000000
F 1
1 1.4277900 1.0000000
F 1
1 0.264721162 1.0000000
G 1
1 1.0539400 1.0000000
G 1
1 0.509539539 1.0000000
POTASSIUM
S 7
1 502601.46805973 0.0002097
2 77029.42847634 0.0015630
3 18313.23433406 0.0075731
4 5597.06775179 0.0276487
5 2026.41879589 0.0848403
6 780.57670159 0.2567788
7 299.2952887 0.7017008
S 2
1 116.42194564 0.5194631
2 46.99119604 0.5171270
S 1
1 19.03931858 1.0000000
S 1
1 7.69562497 1.0000000
S 1
1 3.27142695 1.0000000
S 1
1 0.9969854 1.0000000
S 1
1 0.45596585 1.0000000
S 1
1 0.19485542 1.0000000
S 1
1 0.04536663 1.0000000
S 1
1 0.0190348 1.0000000
S 1
1 0.00513390 1.0000000
P 7
1 2778.07853771 0.0004203
2 682.45402977 0.0033163
3 238.12816942 0.0151886
4 98.41813042 0.0532834
5 42.95346355 0.1609791
6 19.04725562 0.3639630
7 8.56636422 0.5358123
P 2
1 0.78980328 0.5340084
2 0.3485615 0.5154521
P 1
1 3.93408153 1.0000000
P 1
1 1.74026916 1.0000000
P 1
1 0.14545424 1.0000000
P 1
1 0.04248475 1.0000000
P 1
1 0.01650158 1.0000000
D 1
1 2.3932200 1.0000000
D 1
1 0.5569152 1.0000000
D 1
1 0.2202880 1.0000000
D 1
1 0.03823385 1.0000000
F 1
1 0.9039300 1.0000000
F 1
1 0.4513651 1.0000000
F 1
1 0.05084058 1.0000000
G 1
1 0.8027375 1.0000000
G 1
1 0.06183628 1.0000000
SCANDIUM
S 6
1 522379.26470047 0.0006507
2 80375.22728546 0.0048090
3 19347.31001313 0.0226901
4 6058.21591464 0.0795120
5 2232.87883997 0.2418916
6 863.28480708 0.7244609
S 2
1 335.61734385 0.3630453
2 133.95995108 0.6709115
S 2
1 1.4284076 -0.2632987
2 0.70731772 -0.7537780
S 1
1 55.55940374 1.0000000
S 1
1 22.98851808 1.0000000
S 1
1 9.78183279 1.0000000
S 1
1 4.29674035 1.0000000
S 1
1 0.33409709 1.0000000
S 1
1 0.07913081 1.0000000
S 1
1 0.03024907 1.0000000
S 1
1 0.01402312 1.0000000
P 7
1 4796.28874039 0.0002635
2 1160.6179422 0.0021838
3 391.02686598 0.0112336
4 153.90686826 0.0442901
5 65.14326158 0.1433946
6 28.60506386 0.3506111
7 12.85825522 0.5709274
P 2
1 1.21852706 0.5341235
2 0.53952323 0.5149645
P 1
1 5.91473372 1.0000000
P 1
1 2.6768697 1.0000000
P 1
1 0.22150709 1.0000000
P 1
1 0.10870195 1.0000000
P 1
1 0.04915110 1.0000000
P 1
1 0.02207153 1.0000000
D 4
1 42.98491138 0.0156381
2 12.42775703 0.0964932
3 4.34994067 0.3323781
4 1.69203856 0.6981288
D 1
1 0.66842424 1.0000000
D 1
1 0.25892595 1.0000000
D 1
1 0.09306612 1.0000000
D 1
1 0.03291937 1.0000000
F 1
1 1.44963636 1.0000000
F 1
1 0.38839697 1.0000000
F 1
1 0.13949387 1.0000000
F 1
1 0.05224785 1.0000000
G 1
1 0.44578715 1.0000000
G 1
1 0.1683626 1.0000000
G 1
1 0.07133117 1.0000000
H 1
1 0.26476117 1.0000000
H 1
1 0.10677611 1.0000000
TITANIUM
S 7
1 671943.48590126 0.0001834
2 109374.5265337 0.0012824
3 25921.72493593 0.0065109
4 7505.68519257 0.0264943
5 2506.40135959 0.0906175
6 918.95833687 0.2716037
7 355.43892785 0.6855096
S 2
1 1.55683238 -0.2886817
2 0.75669736 -0.7303493
S 1
1 143.08192734 1.0000000
S 1
1 59.67388225 1.0000000
S 1
1 24.49957347 1.0000000
S 1
1 10.64168937 1.0000000
S 1
1 4.71623753 1.0000000
S 1
1 0.36349518 1.0000000
S 1
1 0.08519602 1.0000000
S 1
1 0.0320861 1.0000000
S 1
1 0.0118264 1.0000000
P 7
1 7709.86120886 0.0001146
2 1781.73502797 0.0011234
3 520.54132272 0.0080971
4 172.28280417 0.0432194
5 63.35061159 0.1617352
6 25.32567252 0.3902185
7 10.70426407 0.5339976
P 2
1 0.81631681 0.7423068
2 0.34501095 0.3018568
P 1
1 4.72288119 1.0000000
P 1
1 1.93095649 1.0000000
P 1
1 0.11095699 1.0000000
P 1
1 0.04652053 1.0000000
P 1
1 0.02155312 1.0000000
D 4
1 40.46733765 0.0220996
2 12.49176958 0.1124665
3 4.76372661 0.3363701
4 1.97004682 0.6713671
D 1
1 0.80537091 1.0000000
D 1
1 0.31786595 1.0000000
D 1
1 0.11565987 1.0000000
D 1
1 0.05650390 1.0000000
F 1
1 2.22034769 1.0000000
F 1
1 0.5911078 1.0000000
F 1
1 0.18724764 1.0000000
F 1
1 0.07841202 1.0000000
G 1
1 1.01460858 1.0000000
G 1
1 0.27152978 1.0000000
G 1
1 0.12474546 1.0000000
H 1
1 0.36385878 1.0000000
H 1
1 0.17619947 1.0000000
VANADIUM
S 7
1 559895.80987551 0.0002665
2 86600.23174381 0.0019188
3 21506.74439757 0.0086579
4 6822.02600894 0.0304616
5 2514.81796171 0.0917321
6 990.47556353 0.2634067
7 390.80736724 0.6854231
S 2
1 1.66931423 -0.3249978
2 0.74810449 -0.6999458
S 1
1 155.08812133 1.0000000
S 1
1 62.87500591 1.0000000
S 1
1 23.51418065 1.0000000
S 1
1 10.80738982 1.0000000
S 1
1 4.86536136 1.0000000
S 1
1 0.32354254 1.0000000
S 1
1 0.09725179 1.0000000
S 1
1 0.03556075 1.0000000
S 1
1 0.01071769 1.0000000
P 6
1 5803.34084746 0.0005759
2 1423.55299598 0.0046345
3 493.4213759 0.0221576
4 203.51523332 0.0815171
5 88.47080104 0.2702680
6 38.8023980 0.7095288
P 2
1 17.23790219 -0.5629604
2 7.8345514 -0.4829156
P 2
1 1.60137225 0.5523058
2 0.70713311 0.4969582
P 1
1 3.51593935 1.0000000
P 1
1 0.29027818 1.0000000
P 1
1 0.09495633 1.0000000
P 1
1 0.03205313 1.0000000
D 4
1 62.81274939 0.0136809
2 18.22638504 0.0914014
3 6.43518788 0.3278712
4 2.52689569 0.7033017
D 1
1 1.01376556 1.0000000
D 1
1 0.39887428 1.0000000
D 1
1 0.14483086 1.0000000
D 1
1 0.03566988 1.0000000
F 1
1 3.02282409 1.0000000
F 1
1 0.84550365 1.0000000
F 1
1 0.25290582 1.0000000
F 1
1 0.13564373 1.0000000
G 1
1 1.81605160 1.0000000
G 1
1 0.42216976 1.0000000
G 1
1 0.20210441 1.0000000
H 1
1 0.53820800 1.0000000
H 1
1 0.23561737 1.0000000
CHROMIUM
S 6
1 610839.76782214 0.0007194
2 95856.56677459 0.0051402
3 23663.08184425 0.0234516
4 7474.31772848 0.0829209
5 2755.41299119 0.2477815
6 1087.15499866 0.7145004
S 2
1 428.58885623 0.3605818
2 169.84666018 0.6737558
S 2
1 11.85592917 -0.4871316
2 5.34314115 -0.5413648
S 1
1 68.81146128 1.0000000
S 1
1 25.71632359 1.0000000
S 1
1 1.84268817 1.0000000
S 1
1 0.80572948 1.0000000
S 1
1 0.32935411 1.0000000
S 1
1 0.09587082 1.0000000
S 1
1 0.03482200 1.0000000
S 1
1 0.01168797 1.0000000
P 8
1 5750.7618904 0.0002271
2 1394.40224806 0.0018659
3 477.87081933 0.0090632
4 194.78526094 0.0334585
5 84.5765566 0.1065204
6 37.43309841 0.2615042
7 16.86031349 0.4170035
8 7.78083579 0.3374114
P 1
1 3.49112434 1.0000000
P 1
1 1.60189789 1.0000000
P 1
1 0.71179051 1.0000000
P 1
1 0.2918677 1.0000000
P 1
1 0.09886580 1.0000000
P 1
1 0.0314893 1.0000000
D 4
1 58.29286978 0.0167724
2 16.80718337 0.1062041
3 5.91968919 0.3540635
4 2.30030796 0.6727095
D 1
1 0.89918296 1.0000000
D 1
1 0.33756502 1.0000000
D 1
1 0.11610785 1.0000000
D 1
1 0.03214312 1.0000000
F 1
1 4.19430505 1.0000000
F 1
1 1.25508281 1.0000000
F 1
1 0.36833758 1.0000000
F 1
1 0.15829850 1.0000000
G 1
1 2.91599428 1.0000000
G 1
1 0.80477386 1.0000000
G 1
1 0.27360636 1.0000000
H 1
1 1.82994706 1.0000000
H 1
1 0.4935788 1.0000000
MANGANESE
S 7
1 745841.93643660 0.0002230
2 113937.69164668 0.0016613
3 27162.74449258 0.0080204
4 8302.6929111 0.0293132
5 2981.19315087 0.0912193
6 1150.72531308 0.2645056
7 450.02401626 0.6871245
S 2
1 11.73338242 0.5822666
2 5.34958245 0.4450033
S 1
1 178.08551103 1.0000000
S 1
1 71.76591316 1.0000000
S 1
1 25.11101338 1.0000000
S 1
1 1.99866908 1.0000000
S 1
1 0.85074219 1.0000000
S 1
1 0.30540888 1.0000000
S 1
1 0.11899355 1.0000000
S 1
1 0.04137262 1.0000000
S 1
1 0.01089328 1.0000000
P 5
1 7430.42080552 0.0014588
2 1826.08657918 0.0116851
3 631.31150139 0.0574447
4 253.81967907 0.2275057
5 107.61470524 0.7745033
P 3
1 46.99543274 -0.2460949
2 21.06003289 -0.4466975
3 9.6901725 -0.4027882
P 2
1 2.0109733 0.5542753
2 0.88655802 0.4951535
P 1
1 4.41762404 1.0000000
P 1
1 0.36315473 1.0000000
P 1
1 0.11034656 1.0000000
P 1
1 0.03541863 1.0000000
P 1
1 0.0102312 1.0000000
D 4
1 53.14329841 0.0271811
2 8.14562707 0.2508654
3 3.20367752 0.3494031
4 1.36057342 0.5637100
D 1
1 0.50426349 1.0000000
D 1
1 0.18960559 1.0000000
D 1
1 0.0691822 1.0000000
D 1
1 0.02240288 1.0000000
F 1
1 4.74749382 1.0000000
F 1
1 1.40300058 1.0000000
F 1
1 0.40979291 1.0000000
F 1
1 0.11770970 1.0000000
G 1
1 2.95010956 1.0000000
G 1
1 0.71569319 1.0000000
G 1
1 0.17362635 1.0000000
H 1
1 2.11939028 1.0000000
H 1
1 0.65864537 1.0000000
IRON
S 7
1 731708.48260622 0.0002518
2 114426.68811257 0.0018127
3 27918.20206429 0.0084642
4 8719.2339040 0.0301018
5 3201.73831213 0.0905865
6 1254.05493695 0.2634562
7 490.97792022 0.6873129
S 2
1 2.19725935 -0.3427980
2 0.95463781 -0.6847552
S 1
1 194.44958658 1.0000000
S 1
1 78.90301805 1.0000000
S 1
1 28.78728706 1.0000000
S 1
1 13.66118933 1.0000000
S 1
1 6.26318646 1.0000000
S 1
1 0.39137703 1.0000000
S 1
1 0.10998881 1.0000000
S 1
1 0.03842736 1.0000000
S 1
1 0.00894933 1.0000000
P 5
1 7826.29968188 0.0015846
2 1909.9834695 0.0128921
3 661.59066064 0.0615945
4 273.92953565 0.2273278
5 118.98176669 0.7689502
P 3
1 52.09818243 -0.2444769
2 23.23472506 -0.4515911
3 10.64423981 -0.3998507
P 2
1 2.20153844 0.5586368
2 0.96209981 0.4917468
P 1
1 4.82816097 1.0000000
P 1
1 0.38747974 1.0000000
P 1
1 0.12562229 1.0000000
P 1
1 0.03614892 1.0000000
P 1
1 0.00964892 1.0000000
D 4
1 82.99436295 0.0149191
2 24.4084458 0.0982587
3 8.86707504 0.3373209
4 3.55296127 0.6866712
D 1
1 1.41261957 1.0000000
D 1
1 0.5192081 1.0000000
D 1
1 0.16589825 1.0000000
D 1
1 0.05525400 1.0000000
F 1
1 5.36138051 1.0000000
F 1
1 1.64445029 1.0000000
F 1
1 0.48047748 1.0000000
F 1
1 0.14038649 1.0000000
G 1
1 3.86048815 1.0000000
G 1
1 1.08359034 1.0000000
G 1
1 0.30415014 1.0000000
H 1
1 2.42051017 1.0000000
H 1
1 0.85940407 1.0000000
COBALT
S 6
1 764355.57617579 0.0007073
2 119994.36551016 0.0050631
3 29477.75805825 0.0233192
4 9271.98698367 0.0825496
5 3416.45567199 0.2468993
6 1342.64071632 0.7160087
S 2
1 527.96791946 0.3638635
2 209.10192254 0.6706652
S 2
1 14.19909089 0.5634382
2 6.54887721 0.4633019
S 1
1 84.35091149 1.0000000
S 1
1 29.6272378 1.0000000
S 1
1 2.27424827 1.0000000
S 1
1 0.96129869 1.0000000
S 1
1 0.03524932 1.0000000
S 1
1 0.37788379 1.0000000
S 1
1 0.09953514 1.0000000
S 1
1 0.02115798 1.0000000
P 5
1 8437.21269379 0.0016221
2 2064.97514085 0.0131218
3 716.73026612 0.0625556
4 297.88770278 0.2283910
5 130.39183031 0.7665158
P 3
1 57.28526441 -0.2429232
2 25.53066422 -0.4540393
3 11.67860655 -0.3988079
P 2
1 2.41957216 0.5452616
2 1.06012328 0.5049653
P 1
1 5.28838439 1.0000000
P 1
1 0.42714461 1.0000000
P 1
1 0.13665109 1.0000000
P 1
1 0.03710036 1.0000000
D 4
1 92.02859557 0.0147325
2 26.85250319 0.0996412
3 9.71415658 0.3427884
4 3.89332785 0.6810272
D 1
1 1.55488239 1.0000000
D 1
1 0.57440934 1.0000000
D 1
1 0.18377435 1.0000000
D 1
1 0.04740972 1.0000000
F 1
1 6.09545762 1.0000000
F 1
1 1.88536083 1.0000000
F 1
1 0.55169089 1.0000000
F 1
1 0.17128174 1.0000000
G 1
1 4.59521636 1.0000000
G 1
1 1.30589179 1.0000000
G 1
1 0.44268633 1.0000000
H 1
1 2.80719479 1.0000000
H 1
1 0.84116461 1.0000000
NICKEL
S 7
1 838371.63189714 0.0002554
2 131135.16446667 0.0018323
3 32111.47666786 0.0085154
4 10063.34840055 0.0301204
5 3696.85448395 0.0910854
6 1450.29134031 0.2623830
7 569.22927595 0.6877027
S 2
1 15.21304649 -0.6043760
2 7.03728314 -0.4215487
S 1
1 225.06197219 1.0000000
S 1
1 90.67715888 1.0000000
S 1
1 31.60539723 1.0000000
S 1
1 2.45897092 1.0000000
S 1
1 1.03363615 1.0000000
S 1
1 0.40299452 1.0000000
S 1
1 0.10310477 1.0000000
S 1
1 0.03609939 1.0000000
S 1
1 0.01324173 1.0000000
P 7
1 9044.69545776 0.0002684
2 2217.53361496 0.0021632
3 771.39109739 0.0102726
4 321.00311639 0.0375622
5 140.38687994 0.1264614
6 61.6779111 0.3397831
7 27.52981334 0.5985956
P 2
1 2.6167798 0.5530456
2 1.14856516 0.4969029
P 1
1 12.6173932 1.0000000
P 1
1 5.71237292 1.0000000
P 1
1 0.46324001 1.0000000
P 1
1 0.10980873 1.0000000
P 1
1 0.03389965 1.0000000
P 1
1 0.01062608 1.0000000
D 4
1 101.17257503 0.0146434
2 29.52826363 0.1000947
3 10.69178358 0.3450330
4 4.28299609 0.6787335
D 1
1 1.70981346 1.0000000
D 1
1 0.63218485 1.0000000
D 1
1 0.20247862 1.0000000
D 1
1 0.05379144 1.0000000
F 1
1 6.92371505 1.0000000
F 1
1 2.15738954 1.0000000
F 1
1 0.63208149 1.0000000
F 1
1 0.01633394 1.0000000
G 1
1 5.30257716 1.0000000
G 1
1 1.5217038 1.0000000
G 1
1 0.53185364 1.0000000
H 1
1 3.23283677 1.0000000
H 1
1 1.03953667 1.0000000
COPPER
S 7
1 1310121.85039344 0.0001751
2 198286.03388265 0.0013266
3 47051.86376054 0.0063781
4 14401.92127267 0.0237575
5 4934.85845987 0.0836309
6 1768.29460325 0.2660285
7 665.50940634 0.6997072
S 2
1 113.16180579 -0.7942918
2 48.54884159 -0.2275762
S 1
1 266.60321183 1.0000000
S 1
1 22.84858032 1.0000000
S 1
1 10.74681794 1.0000000
S 1
1 4.93000318 1.0000000
S 1
1 2.12571838 1.0000000
S 1
1 0.8614700 1.0000000
S 1
1 0.10876384 1.0000000
S 1
1 0.03882935 1.0000000
S 1
1 0.01064174 1.0000000
P 5
1 9603.16947275 0.0015197
2 2368.20566881 0.0121390
3 823.55511109 0.0583483
4 335.47332099 0.2269976
5 142.98828784 0.7735010
P 3
1 62.65302044 -0.2641983
2 28.27884222 -0.4673716
3 13.11956609 -0.3615031
P 2
1 2.72133089 0.5803508
2 1.19189102 0.4693936
P 1
1 5.96563072 1.0000000
P 1
1 0.48032676 1.0000000
P 1
1 0.10005624 1.0000000
P 1
1 0.0348478 1.0000000
D 4
1 96.55597291 0.0170587
2 28.40681106 0.1102799
3 10.29610535 0.3616114
4 4.07231523 0.6591267
D 1
1 1.59998363 1.0000000
D 1
1 0.59267623 1.0000000
D 1
1 0.19556089 1.0000000
D 1
1 0.05122435 1.0000000
F 1
1 7.90135114 1.0000000
F 1
1 2.46431063 1.0000000
F 1
1 0.72071578 1.0000000
F 1
1 0.21918468 1.0000000
G 1
1 6.13168353 1.0000000
G 1
1 1.77904928 1.0000000
G 1
1 0.63231066 1.0000000
H 1
1 3.6710473 1.0000000
H 1
1 1.2751795 1.0000000
ZINC
S 7
1 1287673.96746883 0.0001949
2 203144.73158552 0.0013851
3 48919.91062709 0.0067853
4 14846.13506311 0.0249085
5 5247.36170939 0.0824479
6 1951.97886222 0.2531611
7 733.79871748 0.7110742
S 2
1 118.39290857 -0.8633646
2 49.02862689 -0.1539977
S 1
1 286.73160699 1.0000000
S 1
1 23.60315206 1.0000000
S 1
1 11.31356963 1.0000000
S 1
1 5.3684413 1.0000000
S 1
1 2.38319834 1.0000000
S 1
1 0.99167185 1.0000000
S 1
1 0.14988912 1.0000000
S 1
1 0.05173019 1.0000000
S 1
1 0.01912734 1.0000000
P 5
1 10425.01104735 0.0016305
2 2549.9271935 0.0132051
3 886.75681087 0.0625610
4 370.11711648 0.2277047
5 162.25902624 0.7668594
P 3
1 71.44767075 -0.2496615
2 31.98829125 -0.4637572
3 14.69805758 -0.3809586
P 2
1 3.04748238 0.5738968
2 1.35067257 0.4746235
P 1
1 6.64282402 1.0000000
P 1
1 0.55390413 1.0000000
P 1
1 0.15054085 1.0000000
P 1
1 0.043180283 1.0000000
P 1
1 0.007024774 1.0000000
D 4
1 121.16579317 0.0142931
2 35.41514514 0.0997413
3 12.79289924 0.3490387
4 5.09382978 0.6762362
D 1
1 2.04538947 1.0000000
D 1
1 0.78897304 1.0000000
D 1
1 0.27504094 1.0000000
D 1
1 0.02989210 1.0000000
F 1
1 8.83196024 1.0000000
F 1
1 2.80786759 1.0000000
F 1
1 0.84189057 1.0000000
F 1
1 0.21987059 1.0000000
G 1
1 7.10010687 1.0000000
G 1
1 2.09609018 1.0000000
G 1
1 0.72289187 1.0000000
H 1
1 4.43693816 1.0000000
H 1
1 1.56157891 1.0000000
GALLIUM
S 6
1 1298695.83214988 0.0006366
2 200788.38445919 0.0046702
3 48285.74608337 0.0223309
4 14780.05084753 0.0821379
5 5371.50798106 0.2460879
6 2119.18558011 0.7178364
S 2
1 829.10544236 0.3437479
2 324.98315635 0.6905154
S 2
1 22.84333585 -0.4718769
2 10.16141481 -0.5573936
S 1
1 131.50504969 1.0000000
S 1
1 53.42073177 1.0000000
S 1
1 3.49354328 1.0000000
S 1
1 1.52893833 1.0000000
S 1
1 0.62938773 1.0000000
S 1
1 0.20380967 1.0000000
S 1
1 0.07119027 1.0000000
S 1
1 0.02387611 1.0000000
P 5
1 7881.79777224 0.0016311
2 1991.33734901 0.0120712
3 715.4575141 0.0550504
4 285.69964443 0.2280894
5 115.90116624 0.7793250
P 2
1 48.52419439 -0.4642759
2 21.1440597 -0.5859287
P 3
1 4.13676571 -0.4551872
2 1.80182905 -0.5099223
3 0.78521157 -0.1150601
P 1
1 9.42414316 1.0000000
P 1
1 0.31754128 1.0000000
P 1
1 0.1183740 1.0000000
P 1
1 0.04210613 1.0000000
P 1
1 0.01245244 1.0000000
D 4
1 145.00559148 0.0128258
2 42.57077667 0.0927254
3 15.48786932 0.3376040
4 6.23132603 0.6889053
D 1
1 2.54765972 1.0000000
D 1
1 1.01237363 1.0000000
D 1
1 0.30677989 1.0000000
D 1
1 0.04428256 1.0000000
F 1
1 10.35859312 1.0000000
F 1
1 3.30509595 1.0000000
F 1
1 1.00128513 1.0000000
F 1
1 0.29002441 1.0000000
G 1
1 8.11531575 1.0000000
G 1
1 2.43154749 1.0000000
G 1
1 0.76147465 1.0000000
H 1
1 5.21692573 1.0000000
H 1
1 1.83712858 1.0000000
GERMANIUM
S 7
1 1428331.41235193 0.0002291
2 222136.0457463 0.0016518
3 53310.33840171 0.0081074
4 16279.00951174 0.0289478
5 5956.79451408 0.0886755
6 2374.50985191 0.2451992
7 935.75967668 0.7060485
S 2
1 151.85765298 0.8125617
2 64.90220592 0.2080727
S 1
1 369.85702488 1.0000000
S 1
1 25.99090938 1.0000000
S 1
1 11.50436464 1.0000000
S 1
1 3.97606319 1.0000000
S 1
1 1.80823543 1.0000000
S 1
1 0.79400365 1.0000000
S 1
1 0.25523951 1.0000000
S 1
1 0.09096514 1.0000000
S 1
1 0.03028605 1.0000000
P 7
1 8707.26124191 0.0003622
2 2181.97443925 0.0027212
3 785.86071668 0.0121852
4 318.41196863 0.0494230
5 130.61144595 0.1697990
6 55.03904871 0.3959554
7 24.11275851 0.5065728
P 2
1 4.75450143 -0.5286213
2 2.08419008 -0.5216261
P 1
1 10.86843257 1.0000000
P 1
1 0.91649452 1.0000000
P 1
1 0.37338949 1.0000000
P 1
1 0.14798203 1.0000000
P 1
1 0.05580083 1.0000000
P 1
1 0.01915033 1.0000000
D 4
1 168.67269253 0.0118420
2 49.71847065 0.0878077
3 18.2070202 0.3288259
4 7.38773192 0.6981815
D 1
1 3.06219464 1.0000000
D 1
1 1.24311634 1.0000000
D 1
1 0.19732005 1.0000000
D 1
1 0.05410258 1.0000000
F 1
1 11.62631024 1.0000000
F 1
1 3.78871689 1.0000000
F 1
1 1.1772721 1.0000000
F 1
1 0.29703747 1.0000000
G 1
1 9.05036738 1.0000000
G 1
1 2.73667975 1.0000000
G 1
1 0.62956076 1.0000000
H 1
1 6.25679303 1.0000000
H 1
1 2.36624478 1.0000000
ARSENIC
S 7
1 1716177.01305992 0.0002088
2 271584.7419535 0.0014870
3 65413.66076797 0.0072543
4 19582.47014536 0.0278405
5 6912.71789635 0.0872381
6 2683.27784554 0.2547466
7 1053.14611886 0.7001116
S 2
1 173.71581347 0.7337194
2 75.9175561 0.2910611
S 1
1 418.61196114 1.0000000
S 1
1 29.14238395 1.0000000
S 1
1 12.90140705 1.0000000
S 1
1 4.51768445 1.0000000
S 1
1 2.12614937 1.0000000
S 1
1 0.9632715 1.0000000
S 1
1 0.31045504 1.0000000
S 1
1 0.11217054 1.0000000
S 1
1 0.03526822 1.0000000
P 7
1 9635.13525688 0.0003508
2 2398.53646471 0.0026767
3 862.02485402 0.0119217
4 353.03533103 0.0473555
5 146.4442637 0.1628947
6 62.18855524 0.3881746
7 27.42395581 0.5198285
P 2
1 5.45819368 -0.5094803
2 2.41452693 -0.5396843
P 1
1 12.48556771 1.0000000
P 1
1 1.07587087 1.0000000
P 1
1 0.44568682 1.0000000
P 1
1 0.18176994 1.0000000
P 1
1 0.07052522 1.0000000
P 1
1 0.02291008 1.0000000
D 4
1 193.02875917 0.0110931
2 57.03900463 0.0839881
3 20.98852482 0.3221109
4 8.56796225 0.7053481
D 1
1 3.58907268 1.0000000
D 1
1 1.48198501 1.0000000
D 1
1 0.26945182 1.0000000
D 1
1 0.071388073 1.0000000
F 1
1 12.3678224 1.0000000
F 1
1 4.00163389 1.0000000
F 1
1 1.21181114 1.0000000
F 1
1 0.32527442 1.0000000
G 1
1 10.01660511 1.0000000
G 1
1 3.03889169 1.0000000
G 1
1 0.53685724 1.0000000
H 1
1 7.20413237 1.0000000
H 1
1 2.69433156 1.0000000
SELENIUM
S 6
1 2015991.27464577 0.0005831
2 319942.80174378 0.0041679
3 76996.18440198 0.0202347
4 22912.93627954 0.0796364
5 8068.37770527 0.2443185
6 3149.28809031 0.7239801
S 2
1 1241.78358941 0.3273982
2 494.37486464 0.7049661
S 2
1 205.63746625 0.7001008
2 90.0485096 0.3262663
S 1
1 33.01979722 1.0000000
S 1
1 14.65147888 1.0000000
S 1
1 5.28729276 1.0000000
S 1
1 2.58108525 1.0000000
S 1
1 1.1951145 1.0000000
S 1
1 0.37130084 1.0000000
S 1
1 0.13497635 1.0000000
S 1
1 0.04199053 1.0000000
P 7
1 10434.13729364 0.0003437
2 2595.11468316 0.0026289
3 933.79476536 0.0116534
4 383.9755406 0.0461518
5 159.55751622 0.1599199
6 67.75332234 0.3860249
7 29.86949303 0.5251603
P 2
1 5.93935851 -0.5082685
2 2.63411904 -0.5405984
P 1
1 13.60295522 1.0000000
P 1
1 1.17291804 1.0000000
P 1
1 0.49678013 1.0000000
P 1
1 0.20083001 1.0000000
P 1
1 0.07684892 1.0000000
P 1
1 0.02653857 1.0000000
D 4
1 217.69779484 0.0105474
2 64.49563172 0.0810730
3 23.84904162 0.3166529
4 9.7915055 0.7108974
D 1
1 4.13808644 1.0000000
D 1
1 1.73216503 1.0000000
D 1
1 0.31493910 1.0000000
D 1
1 0.077897563 1.0000000
F 1
1 11.20457542 1.0000000
F 1
1 3.37455764 1.0000000
F 1
1 0.75327766 1.0000000
F 1
1 0.29612202 1.0000000
G 1
1 10.74346368 1.0000000
G 1
1 3.1970828 1.0000000
G 1
1 0.58563608 1.0000000
H 1
1 8.46499684 1.0000000
H 1
1 3.1954334 1.0000000
BROMINE
S 6
1 2329484.35354656 -0.0006077
2 371432.1159543 -0.0042019
3 89986.59833767 -0.0209803
4 26870.5723191 -0.0785770
5 9460.70428706 -0.2573810
6 3707.64391472 -0.7116060
S 2
1 1469.4972467 0.3179955
2 585.11428474 0.7138344
S 2
1 242.34214779 0.6255677
2 104.8951208 0.4043322
S 1
1 37.22805803 1.0000000
S 1
1 16.69655768 1.0000000
S 1
1 6.49396884 1.0000000
S 1
1 3.16231364 1.0000000
S 1
1 1.4550506 1.0000000
S 1
1 0.43718409 1.0000000
S 1
1 0.15966359 1.0000000
S 1
1 0.04926543 1.0000000
P 7
1 11360.2672519 0.0003349
2 2815.59115890 0.0025829
3 1010.37454429 0.0114911
4 416.62865112 0.0451703
5 173.9856566 0.1566063
6 74.14875404 0.3822641
7 32.77967357 0.5315631
P 2
1 6.54130875 -0.4975563
2 2.91704958 -0.5506053
P 1
1 14.9743130 1.0000000
P 1
1 1.3042278 1.0000000
P 1
1 0.56686278 1.0000000
P 1
1 0.23116139 1.0000000
P 1
1 0.0890900 1.0000000
P 1
1 0.0314360 1.0000000
D 4
1 242.8128976 0.0101137
2 72.08159580 0.0787220
3 26.75801058 0.3123047
4 11.0353965 0.7153331
D 1
1 4.69749726 1.0000000
D 1
1 1.9888282 1.0000000
D 1
1 0.36160513 1.0000000
D 1
1 0.090054205 1.0000000
F 1
1 11.97051996 1.0000000
F 1
1 3.60342506 1.0000000
F 1
1 0.75044686 1.0000000
F 1
1 0.33468830 1.0000000
G 1
1 11.48436016 1.0000000
G 1
1 3.33832677 1.0000000
G 1
1 0.65864639 1.0000000
H 1
1 9.57795878 1.0000000
H 1
1 0.83556010 1.0000000
KRYPTON
S 8
1 2653676.39131574 0.0000831
2 423195.86675987 0.0005851
3 102661.34184817 0.0028345
4 30672.20723159 0.0110513
5 10780.38925442 0.0346418
6 4231.17046949 0.1001899
7 1684.6319505 0.2833743
8 671.57170598 0.6544744
S 1
1 277.00762222 1.0000000
S 1
1 118.60575318 1.0000000
S 1
1 41.3125547 1.0000000
S 1
1 18.82987548 1.0000000
S 1
1 7.87647522 1.0000000
S 1
1 3.69313279 1.0000000
S 1
1 1.68825448 1.0000000
S 1
1 0.50446453 1.0000000
S 1
1 0.18523168 1.0000000
S 1
1 0.05661719 1.0000000
P 7
1 12287.09779232 0.0003297
2 3035.66112362 0.0025637
3 1087.69307125 0.0113821
4 451.41847744 0.0441149
5 189.86511938 0.1529026
6 81.26945995 0.3779565
7 36.03359501 0.5387202
P 2
1 7.21310592 -0.4924647
2 3.23437535 -0.5550268
P 1
1 16.51251254 1.0000000
P 1
1 1.45257812 1.0000000
P 1
1 0.64196404 1.0000000
P 1
1 0.26417217 1.0000000
P 1
1 0.10280441 1.0000000
P 1
1 0.03423799 1.0000000
D 4
1 268.68386278 0.0097689
2 79.93856282 0.0767822
3 29.79094338 0.3085831
4 12.34160892 0.7189745
D 1
1 5.28987352 1.0000000
D 1
1 2.2619811 1.0000000
D 1
1 0.89100881 1.0000000
D 1
1 0.09909504 1.0000000
F 1
1 13.11566106 1.0000000
F 1
1 3.9834403 1.0000000
F 1
1 0.82940546 1.0000000
F 1
1 0.40310276 1.0000000
G 1
1 9.08514012 1.0000000
G 1
1 1.04387071 1.0000000
G 1
1 0.21993938 1.0000000
H 1
1 10.64333821 1.0000000
H 1
1 4.311824702 1.0000000
RUBIDIUM
S 9
1 3519452.58283965 -0.0000642
2 595372.89265089 -0.0003979
3 158277.42171937 -0.0017132
4 55142.9738135 -0.0047100
5 22896.85117876 -0.0141706
6 9650.70640438 -0.0368508
7 4102.08225117 -0.1114748
8 1758.40067876 -0.2616250
9 740.85269499 -0.6552400
S 2
1 313.69771054 0.5686630
2 135.18826647 0.4627153
S 2
1 23.64915941 -0.7734643
2 11.1357268 -0.2450769
S 2
1 4.72314263 0.4285849
2 2.18131961 0.5975738
S 1
1 49.68619767 1.0000000
S 1
1 0.72945414 1.0000000
S 1
1 0.36076665 1.0000000
S 1
1 0.17110339 1.0000000
S 1
1 0.03295734 1.0000000
S 1
1 0.01395377 1.0000000
S 1
1 0.00457999 1.0000000
P 8
1 23290.60786488 0.0001126
2 5690.44096933 0.0009207
3 1947.55703685 0.0046927
4 798.68795339 0.0176087
5 358.59728367 0.0586928
6 161.45249101 0.1776216
7 72.45845295 0.3896335
8 33.18207686 0.4862332
P 2
1 7.09284943 -0.4829405
2 3.27680431 -0.5611588
P 2
1 0.70517128 0.4928235
2 0.31019819 0.5568273
P 1
1 15.49058148 1.0000000
P 1
1 1.48593684 1.0000000
P 1
1 0.12832868 1.0000000
P 1
1 0.05159998 1.0000000
P 1
1 0.01611407 1.0000000
P 1
1 0.07798588 1.0000000
D 5
1 125.94392709 0.0216068
2 36.59084291 0.1313051
3 13.00356031 0.3636215
4 4.8189384 0.4941988
5 1.70181202 0.2602818
D 1
1 0.92747304 1.0000000
D 1
1 0.46986732 1.0000000
D 1
1 0.1422079 1.0000000
D 1
1 0.03207891 1.0000000
F 1
1 0.12797474 1.0000000
F 1
1 0.52160842 1.0000000
F 1
1 0.03750998 1.0000000
G 1
1 0.12239212 1.0000000
G 1
1 0.04269988 1.0000000
YTTRIUM
S 10
1 4208530.75799019 0.0000327
2 698825.81856951 0.0002209
3 174576.99492589 0.0009858
4 61409.89224565 0.0026345
5 25779.83330852 0.0077401
6 10656.35360953 0.0220604
7 4531.67367219 0.0607254
8 1965.36238955 0.1489748
9 839.74510374 0.3495668
10 361.56364350 0.5130419
S 2
1 57.83675173 0.3082826
2 27.77464687 0.7121416
S 2
1 5.74385112 0.4238846
2 2.72934697 0.6003837
S 1
1 156.69217483 1.0000000
S 1
1 13.32515355 1.0000000
S 1
1 0.9856287 1.0000000
S 1
1 0.48609245 1.0000000
S 1
1 0.22681108 1.0000000
S 1
1 0.07631014 1.0000000
S 1
1 0.02932865 1.0000000
S 1
1 0.0090500 1.0000000
P 8
1 17959.87495179 0.0001879
2 4969.05895366 0.0013247
3 1770.04010243 0.0060826
4 760.20682526 0.0220526
5 338.84785624 0.0731824
6 157.50306513 0.1918597
7 74.08931382 0.3873367
8 34.88238961 0.4565978
P 2
1 7.97866487 -0.4809835
2 3.87072622 -0.5579510
P 2
1 0.86780823 0.5470785
2 0.39317935 0.4993320
P 1
1 16.48617662 1.0000000
P 1
1 1.84524396 1.0000000
P 1
1 0.16398128 1.0000000
P 1
1 0.0647968 1.0000000
D 6
1 377.02441414 0.0033053
2 117.08848707 0.0249594
3 45.22733882 0.1063896
4 18.98535272 0.2822611
5 8.30211135 0.4317088
6 3.71323969 0.3673829
D 1
1 1.64557338 1.0000000
D 1
1 0.63548077 1.0000000
D 1
1 0.23216705 1.0000000
D 1
1 0.07691790 1.0000000
D 1
1 0.03499991 1.0000000
F 1
1 0.8571458 1.0000000
F 1
1 0.2637349 1.0000000
F 1
1 0.1065454 1.0000000
F 1
1 0.04659097 1.0000000
G 1
1 0.3406359 1.0000000
G 1
1 0.13768795 1.0000000
G 1
1 0.01551702 1.0000000
H 1
1 0.2264853 1.0000000
H 1
1 0.09589623 1.0000000
ZIRCONIUM
S 10
1 3957921.99538276 0.0000376
2 667533.27911541 0.0002409
3 176579.04018383 0.0009959
4 61852.67208840 0.0029026
5 25870.72619251 0.0077742
6 11109.40375712 0.0218002
7 4804.90855953 0.0587198
8 2084.95267282 0.1495570
9 895.18320626 0.3371772
10 385.2254078 0.5263517
S 2
1 30.26666926 0.5646497
2 14.4803999 0.4596808
S 2
1 6.18295089 0.4155884
2 2.93495455 0.6085937
S 1
1 166.91231716 1.0000000
S 1
1 62.44235159 1.0000000
S 1
1 1.00659152 1.0000000
S 1
1 0.48834338 1.0000000
S 1
1 0.20576835 1.0000000
S 1
1 0.07733708 1.0000000
S 1
1 0.0295011 1.0000000
P 8
1 18152.55350824 0.0002180
2 4865.88648011 0.0014543
3 1815.5893232 0.0064029
4 777.77329812 0.0229485
5 359.03742251 0.0705411
6 169.11416263 0.1911630
7 79.37378024 0.3876775
8 37.69782928 0.4565495
P 2
1 8.5864300 -0.4894513
2 4.12214374 -0.5506551
P 2
1 0.94412839 0.5630193
2 0.43636012 0.4810076
P 1
1 18.10166568 1.0000000
P 1
1 1.9413307 1.0000000
P 1
1 0.18191863 1.0000000
P 1
1 0.07145562 1.0000000
D 6
1 393.9958785 0.0034201
2 121.75199101 0.0260581
3 46.92988924 0.1105144
4 19.69833002 0.2900246
5 8.57000535 0.4377115
6 3.79181325 0.3518557
D 1
1 1.63799072 1.0000000
D 1
1 0.65878172 1.0000000
D 1
1 0.25411535 1.0000000
D 1
1 0.09115101 1.0000000
D 1
1 0.04494991 1.0000000
F 1
1 1.1155360 1.0000000
F 1
1 0.3525771 1.0000000
F 1
1 0.1350150 1.0000000
F 1
1 0.066740189 1.0000000
G 1
1 0.5816601 1.0000000
G 1
1 0.1976100 1.0000000
G 1
1 0.0858000 1.0000000
H 1
1 0.3176001 1.0000000
H 1
1 0.12589991 1.0000000
NIOBIUM
S 9
1 7986772.15583951 0.0000390
2 1284903.42597761 0.0002555
3 325451.04752318 0.0012117
4 108153.89675858 0.0035199
5 40061.12794566 0.0135975
6 16110.17312619 0.0299801
7 6876.8441376 0.1058195
8 2901.72025843 0.2310562
9 1212.25415773 0.6956540
S 2
1 505.3957941 0.4567335
2 211.0680636 0.5768070
S 2
1 81.61112439 0.0278962
2 38.50324007 0.9747718
S 2
1 7.12275568 -0.3385703
2 3.36592723 -0.6838339
S 1
1 17.83600264 1.0000000
S 1
1 1.17147878 1.0000000
S 1
1 0.58066154 1.0000000
S 1
1 0.27388507 1.0000000
S 1
1 0.0790878 1.0000000
S 1
1 0.03074886 1.0000000
S 1
1 0.00861999 1.0000000
P 8
1 29818.62810071 0.0001111
2 7407.90918163 0.0008830
3 2549.23550696 0.0045188
4 1047.39037356 0.0168477
5 477.20052399 0.0546644
6 218.96925705 0.1654770
7 99.84611123 0.3763287
8 46.36509232 0.5096630
P 2
1 10.05559889 -0.4578078
2 4.74488091 -0.5836193
P 2
1 1.07222122 0.5579421
2 0.48593642 0.4883190
P 1
1 22.00491763 1.0000000
P 1
1 2.2219457 1.0000000
P 1
1 0.20025051 1.0000000
P 1
1 0.05362352 1.0000000
P 1
1 0.02018068 1.0000000
D 6
1 461.53172459 0.0028138
2 140.55127077 0.0229919
3 52.80969103 0.1060644
4 21.65825165 0.2909822
5 9.32818565 0.4428100
6 4.12668414 0.3516725
D 1
1 1.78394636 1.0000000
D 1
1 0.73148224 1.0000000
D 1
1 0.27630406 1.0000000
D 1
1 0.09409131 1.0000000
D 1
1 0.0297001 1.0000000
F 1
1 0.5553932 1.0000000
F 1
1 0.2012060 1.0000000
F 1
1 1.5549534 1.0000000
F 1
1 0.07140211 1.0000000
G 1
1 1.0825611 1.0000000
G 1
1 0.3458067 1.0000000
G 1
1 0.12326544 1.0000000
H 1
1 0.7341580 1.0000000
H 1
1 0.24447443 1.0000000
MOLYBDENUM
S 9
1 8853221.37420794 0.0000379
2 1392368.70011483 0.0002522
3 355910.6484217 0.0011786
4 117447.20708439 0.0035196
5 43262.35937691 0.0134303
6 17530.98100755 0.0293500
7 7450.49177535 0.1054077
8 3142.71763153 0.2283986
9 1312.44354014 0.6990433
S 2
1 544.07665252 0.4503064
2 226.56438931 0.5833359
S 2
1 89.14707942 0.0084886
2 41.60762716 0.9923608
S 2
1 7.41058578 -0.3603274
2 3.55385918 -0.6619188
S 1
1 19.22552249 1.0000000
S 1
1 1.21883141 1.0000000
S 1
1 0.59904557 1.0000000
S 1
1 0.26478445 1.0000000
S 1
1 0.08589245 1.0000000
S 1
1 0.03265097 1.0000000
S 1
1 0.00789991 1.0000000
P 8
1 23929.31676656 0.0001686
2 6211.53582980 0.0012177
3 2228.8558589 0.0057699
4 938.55601027 0.0207715
5 433.70053764 0.0644266
6 203.65969482 0.1806518
7 95.36539765 0.3808367
8 45.30934018 0.4784156
P 2
1 10.21742915 -0.4789001
2 4.90067252 -0.5611819
P 2
1 1.14005468 0.5698459
2 0.52627171 0.4742080
P 1
1 21.85224555 1.0000000
P 1
1 2.31210156 1.0000000
P 1
1 0.21983519 1.0000000
P 1
1 0.097713519 1.0000000
P 1
1 0.034022219 1.0000000
P 1
1 0.01299991 1.0000000
D 6
1 579.88059314 0.0020127
2 175.77941708 0.0173523
3 65.95981215 0.0853612
4 26.9253105 0.2607113
5 11.47078725 0.4466390
6 5.01303264 0.3947461
D 1
1 2.17024396 1.0000000
D 1
1 0.89586843 1.0000000
D 1
1 0.34119024 1.0000000
D 1
1 0.11633302 1.0000000
D 1
1 0.03679989 1.0000000
F 1
1 1.7511922 1.0000000
F 1
1 0.624073971 1.0000000
F 1
1 0.2222873 1.0000000
F 1
1 0.07772481 1.0000000
G 1
1 1.3059451 1.0000000
G 1
1 0.4350817 1.0000000
G 1
1 0.1533103 1.0000000
H 1
1 0.9171006 1.0000000
H 1
1 0.30995753 1.0000000
TECHNETIUM
S 9
1 5343670.67910819 0.0000557
2 867521.0133861 0.0003722
3 221199.50301646 0.0016680
4 73171.34522516 0.0052505
5 28340.67701962 0.0161930
6 11815.03306192 0.0409651
7 5174.02941008 0.1143533
8 2269.37620448 0.2695662
9 977.75899808 0.6385975
S 2
1 423.28892942 0.5715965
2 185.49944656 0.4585519
S 2
1 33.82974415 0.7335738
2 16.44389294 0.2853168
S 2
1 7.23545406 0.4145638
2 3.56062747 0.6074095
S 1
1 69.15272075 1.0000000
S 1
1 1.37861996 1.0000000
S 1
1 0.66867481 1.0000000
S 1
1 0.30067263 1.0000000
S 1
1 0.09297801 1.0000000
S 1
1 0.03493287 1.0000000
S 1
1 0.00999991 1.0000000
P 8
1 22761.79576222 0.0002014
2 5944.64286819 0.0014161
3 2180.16321358 0.0063638
4 939.27277673 0.0219678
5 442.21709522 0.0662304
6 210.54479898 0.1822530
7 99.75453279 0.3788539
8 47.89463147 0.4744386
P 2
1 11.01389232 -0.4741203
2 5.35147105 -0.5645690
P 2
1 1.26985974 0.5711000
2 0.59101896 0.4720408
P 1
1 23.32074025 1.0000000
P 1
1 2.5699496 1.0000000
P 1
1 0.24904459 1.0000000
P 1
1 0.10787569 1.0000000
P 1
1 0.03552299 1.0000000
P 1
1 0.01249991 1.0000000
D 6
1 526.69461231 0.0027932
2 160.76947732 0.0224367
3 62.25682204 0.0981478
4 26.3416594 0.2735344
5 11.52370291 0.4421480
6 5.15198832 0.3692073
D 1
1 2.27258368 1.0000000
D 1
1 0.96125036 1.0000000
D 1
1 0.37159913 1.0000000
D 1
1 0.12632233 1.0000000
D 1
1 0.03909989 1.0000000
F 1
1 2.0654432 1.0000000
F 1
1 0.77362475 1.0000000
F 1
1 0.28525392 1.0000000
F 1
1 0.1028521 1.0000000
G 1
1 1.4704785 1.0000000
G 1
1 0.4987754 1.0000000
G 1
1 0.20590535 1.0000000
H 1
1 1.0410639 1.0000000
H 1
1 0.46095612 1.0000000
RUTHENIUM
S 9
1 5552991.54803948 0.0000578
2 930754.7330615 0.0003660
3 242442.19403952 0.0016284
4 81494.16671625 0.0049032
5 31776.60355699 0.0157068
6 13280.84307932 0.0381786
7 5752.72726417 0.1152014
8 2503.63673044 0.2593288
9 1078.13588085 0.6505483
S 2
1 464.75335336 0.5469246
2 201.79695006 0.4841444
S 2
1 36.78140732 0.7110060
2 17.75879525 0.3091677
S 2
1 7.57078335 0.4467450
2 3.6931513 0.5762287
S 1
1 75.10230998 1.0000000
S 1
1 1.3602404 1.0000000
S 1
1 0.61180223 1.0000000
S 1
1 0.22138536 1.0000000
S 1
1 0.08047495 1.0000000
S 1
1 0.03033916 1.0000000
P 8
1 25679.49563342 0.0001799
2 6799.07187118 0.0012305
3 2511.58737101 0.0055579
4 1070.88003097 0.0200340
5 497.64927735 0.0616724
6 235.73002545 0.1733909
7 110.93506602 0.3751066
8 52.82976112 0.4918701
P 2
1 11.94980982 -0.4672893
2 5.77677618 -0.5718165
P 2
1 1.36549604 0.5768989
2 0.63137573 0.4668488
P 1
1 25.5600411 1.0000000
P 1
1 2.76210552 1.0000000
P 1
1 0.2641138 1.0000000
P 1
1 0.1254769 1.0000000
P 1
1 0.0420803 1.0000000
P 1
1 0.01831091 1.0000000
D 6
1 662.49900734 0.0019296
2 203.04763748 0.0163833
3 77.04340706 0.0808282
4 31.63595856 0.2538354
5 13.49684045 0.4490212
6 5.90600782 0.4004860
D 1
1 2.54459782 1.0000000
D 1
1 1.06789496 1.0000000
D 1
1 0.41137167 1.0000000
D 1
1 0.14041837 1.0000000
D 1
1 0.03859809 1.0000000
F 1
1 2.2031485 1.0000000
F 1
1 0.8144435 1.0000000
F 1
1 0.2939862 1.0000000
F 1
1 0.125216477 1.0000000
G 1
1 1.6638372 1.0000000
G 1
1 0.5759334 1.0000000
G 1
1 0.14977574 1.0000000
H 1
1 1.2009679 1.0000000
H 1
1 0.538828847 1.0000000
RHODIUM
S 9
1 5643039.71728898 0.0000588
2 946791.23783555 0.0003735
3 246941.41404617 0.0016463
4 82987.36984449 0.0050280
5 32370.20731534 0.0157840
6 13538.12971113 0.0392063
7 5867.16427343 0.1152223
8 2557.80328059 0.2637780
9 1102.41124187 0.6452858
S 2
1 475.92322602 0.5581682
2 207.40048532 0.4725389
S 2
1 37.74586617 0.7357112
2 18.21686721 0.2834575
S 2
1 7.87911569 0.4705328
2 3.8594262 0.5524164
S 1
1 77.40307721 1.0000000
S 1
1 1.44336925 1.0000000
S 1
1 0.63712018 1.0000000
S 1
1 0.20881054 1.0000000
S 1
1 0.08062559 1.0000000
S 1
1 0.03032287 1.0000000
P 8
1 25189.20792567 0.0001989
2 6598.44519896 0.0013942
3 2418.8102956 0.0062965
4 1034.05727487 0.0223293
5 482.76936362 0.0672833
6 230.97296596 0.1819290
7 110.10007853 0.3777783
8 53.04356296 0.4740186
P 2
1 12.25861473 -0.4845069
2 5.99691092 -0.5536154
P 2
1 1.44298003 0.5854112
2 0.67416519 0.4570382
P 1
1 25.88672384 1.0000000
P 1
1 2.89053411 1.0000000
P 1
1 0.2837988 1.0000000
P 1
1 0.13746079 1.0000000
P 1
1 0.04957988 1.0000000
P 1
1 0.02173686 1.0000000
D 6
1 548.02747957 0.0031708
2 168.97511687 0.0249599
3 65.4828737 0.1075342
4 27.78840724 0.2895335
5 12.17274678 0.4479083
6 5.43475929 0.3390805
D 1
1 2.30865168 1.0000000
D 1
1 0.97090852 1.0000000
D 1
1 0.38174045 1.0000000
D 1
1 0.13544014 1.0000000
D 1
1 0.05200394 1.0000000
F 1
1 2.5680785 1.0000000
F 1
1 0.9990881 1.0000000
F 1
1 0.3689620 1.0000000
F 1
1 0.12324476 1.0000000
G 1
1 1.8685202 1.0000000
G 1
1 0.6486500 1.0000000
G 1
1 0.26369321 1.0000000
H 1
1 1.4004832 1.0000000
H 1
1 0.57009734 1.0000000
PALLADIUM
S 10
1 17997134.02787254 0.0000273
2 3088261.46922638 0.0001672
3 872149.75428925 0.0006098
4 311770.82130834 0.0019969
5 116876.86093058 0.0064751
6 47642.38670558 0.0174832
7 21291.79403552 0.0439103
8 9767.7280265 0.1117034
9 4518.69460804 0.2719896
10 2088.69988971 0.6265808
S 2
1 959.92061329 -0.4319401
2 442.05549627 -0.5944633
S 2
1 42.2738696 -0.5912056
2 20.82783799 -0.4309561
S 1
1 204.30063929 1.0000000
S 1
1 85.33309073 1.0000000
S 1
1 9.19996715 1.0000000
S 1
1 4.59955836 1.0000000
S 1
1 1.94921729 1.0000000
S 1
1 0.9394112 1.0000000
S 1
1 0.40137378 1.0000000
S 1
1 0.10999991 1.0000000
P 8
1 26070.3129745 0.0002012
2 6821.53857487 0.0014141
3 2498.88434382 0.0063852
4 1069.17134315 0.0225674
5 499.2137432 0.0680981
6 238.64267771 0.1837162
7 113.69411731 0.3795405
8 54.71505176 0.4701089
P 2
1 12.62169159 -0.5012475
2 6.18314428 -0.5368639
P 2
1 1.47776484 0.6024296
2 0.69045101 0.4395901
P 1
1 26.64123326 1.0000000
P 1
1 2.95722303 1.0000000
P 1
1 0.28790819 1.0000000
P 1
1 0.0698190 1.0000000
P 1
1 0.02099991 1.0000000
D 6
1 547.57418537 0.0035152
2 169.79225963 0.0270930
3 66.07951991 0.1143656
4 28.0767873 0.3020541
5 12.25431275 0.4529898
6 5.45380628 0.3152559
D 1
1 2.27812888 1.0000000
D 1
1 0.93370268 1.0000000
D 1
1 0.35338639 1.0000000
D 1
1 0.11894496 1.0000000
D 1
1 0.04999991 1.0000000
F 1
1 2.7195773 1.0000000
F 1
1 1.0484253 1.0000000
F 1
1 0.3681696 1.0000000
F 1
1 0.11981999 1.0000000
G 1
1 2.0325060 1.0000000
G 1
1 0.7042661 1.0000000
G 1
1 0.2932000 1.0000000
H 1
1 1.5341688 1.0000000
H 1
1 0.5812998 1.0000000
SILVER
S 9
1 9842549.81841184 -0.0000351
2 1502374.90803674 -0.0002556
3 360718.71522792 -0.0012597
4 113516.92766391 -0.0041383
5 41964.43715579 -0.0139244
6 17077.17042534 -0.0342589
7 7224.67103037 -0.1087028
8 3037.23767569 -0.2575613
9 1269.28985572 -0.6649481
S 2
1 537.35593508 0.5443704
2 231.16524128 0.4873841
S 2
1 41.34409855 0.7376431
2 20.00797877 0.2812986
S 2
1 8.81438654 0.4831395
2 4.36427179 0.5392235
S 1
1 84.50109238 1.0000000
S 1
1 1.62320875 1.0000000
S 1
1 0.7049248 1.0000000
S 1
1 0.21159348 1.0000000
S 1
1 0.08198065 1.0000000
S 1
1 0.03031733 1.0000000
S 1
1 0.0091700 1.0000000
P 8
1 26894.58061921 0.0002075
2 7233.56013934 0.0013869
3 2690.87320805 0.0061520
4 1160.66180842 0.0216392
5 543.56110582 0.0656684
6 260.32738188 0.1784778
7 124.48959664 0.3743315
8 60.18304311 0.4813051
P 2
1 13.97229242 -0.4787431
2 6.87472587 -0.5587327
P 2
1 1.65183763 0.5987231
2 0.7679302 0.4439337
P 1
1 29.47524611 1.0000000
P 1
1 3.33230255 1.0000000
P 1
1 0.32366057 1.0000000
P 1
1 0.12398157 1.0000000
P 1
1 0.04473257 1.0000000
P 1
1 0.01999991 1.0000000
D 6
1 627.97927467 0.0029912
2 193.09624497 0.0240122
3 74.77735164 0.1050341
4 31.81802088 0.2865993
5 14.01162496 0.4491403
6 6.30957362 0.3402113
D 1
1 2.70853231 1.0000000
D 1
1 1.14829229 1.0000000
D 1
1 0.45589902 1.0000000
D 1
1 0.16387095 1.0000000
D 1
1 0.00299991 1.0000000
F 1
1 3.1602536 1.0000000
F 1
1 1.2439035 1.0000000
F 1
1 0.4586604 1.0000000
F 1
1 0.1637700 1.0000000
G 1
1 2.3301673 1.0000000
G 1
1 0.8326207 1.0000000
G 1
1 0.36939999 1.0000000
H 1
1 1.7762555 1.0000000
H 1
1 0.7634999 1.0000000
CADMIUM
S 9
1 4870072.35520374 0.0000779
2 884213.43404687 0.0004306
3 251816.4057371 0.0017235
4 85818.27320164 0.0055501
5 33762.00451926 0.0162189
6 14297.08142042 0.0421564
7 6215.27645162 0.1166895
8 2729.26523478 0.2752210
9 1185.97024254 0.6295043
S 2
1 515.18080044 -0.5870606
2 226.56754867 -0.4426001
S 2
1 41.34782674 -0.7910440
2 19.8823817 -0.2255294
S 2
1 8.98321378 -0.5202008
2 4.4411229 -0.5023186
S 1
1 85.50636431 1.0000000
S 1
1 1.74703695 1.0000000
S 1
1 0.75036966 1.0000000
S 1
1 0.13803713 1.0000000
S 1
1 0.06686915 1.0000000
S 1
1 0.03079219 1.0000000
S 1
1 0.0829946 1.0000000
P 8
1 27854.36247205 0.0002190
2 7547.47554011 0.0013970
3 2924.01245021 0.0057153
4 1280.96687319 0.0205246
5 598.14808674 0.0628085
6 288.20413537 0.1702158
7 138.66772833 0.3668240
8 67.20948711 0.4978270
P 2
1 15.61173904 -0.4526726
2 7.71432108 -0.5839738
P 2
1 1.90472884 0.5743013
2 0.89419166 0.4678528
P 1
1 32.9809847 1.0000000
P 1
1 3.81621263 1.0000000
P 1
1 0.37970183 1.0000000
P 1
1 0.12118093 1.0000000
P 1
1 0.0458843 1.0000000
P 1
1 0.01873686 1.0000000
D 6
1 887.45175755 0.0016800
2 263.55213332 0.0155187
3 98.92097628 0.0786683
4 40.97669782 0.2481586
5 17.79916569 0.4462092
6 7.96929051 0.4038028
D 1
1 3.51409872 1.0000000
D 1
1 1.53713506 1.0000000
D 1
1 0.62718117 1.0000000
D 1
1 0.23000817 1.0000000
D 1
1 0.030193355 1.0000000
F 1
1 3.3682004 1.0000000
F 1
1 1.2860008 1.0000000
F 1
1 0.4762710 1.0000000
F 1
1 0.177622525 1.0000000
G 1
1 2.6269138 1.0000000
G 1
1 0.9594397 1.0000000
G 1
1 0.3946535 1.0000000
H 1
1 1.9814840 1.0000000
H 1
1 0.90345108 1.0000000
INDIUM
S 9
1 6363779.85581275 0.0000621
2 1033725.38461644 0.0004137
3 266277.84749951 0.0018141
4 88737.85593801 0.0057204
5 34640.0274537 0.0171029
6 14716.09784381 0.0425083
7 6491.4644759 0.1181137
8 2875.16247422 0.2723662
9 1260.79295973 0.6291973
S 2
1 553.36515541 0.5690645
2 244.58197091 0.4605191
S 2
1 45.95472163 -0.7215103
2 22.50730743 -0.2974830
S 2
1 9.83386288 0.4791984
2 4.89760808 0.5427859
S 1
1 93.31160783 1.0000000
S 1
1 1.92978078 1.0000000
S 1
1 0.85122055 1.0000000
S 1
1 0.19277786 1.0000000
S 1
1 0.09590047 1.0000000
S 1
1 0.04352169 1.0000000
S 1
1 0.01799991 1.0000000
P 8
1 25143.81282831 0.0002427
2 6368.89414302 0.0018346
3 2271.40883392 0.0084121
4 966.95324193 0.0293552
5 442.59393471 0.0906755
6 204.94698014 0.2347733
7 95.49105095 0.4128255
8 45.12677184 0.3728305
P 2
1 10.03755511 0.8010615
2 4.95101819 0.2240797
P 2
1 2.35594301 0.5255659
2 1.08981369 0.5186569
P 1
1 20.69988709 1.0000000
P 1
1 0.48409701 1.0000000
P 1
1 0.16314831 1.0000000
P 1
1 0.0612784 1.0000000
P 1
1 0.02353486 1.0000000
D 6
1 970.64025906 0.0015657
2 286.10892856 0.0147686
3 107.18384549 0.0758771
4 44.53183365 0.2412923
5 19.48531016 0.4417379
6 8.78833462 0.4146177
D 1
1 3.91670539 1.0000000
D 1
1 1.73975535 1.0000000
D 1
1 0.72957248 1.0000000
D 1
1 0.26921494 1.0000000
D 1
1 0.03857991 1.0000000
F 1
1 3.5971233 1.0000000
F 1
1 1.3648294 1.0000000
F 1
1 0.5110392 1.0000000
F 1
1 0.17766969 1.0000000
G 1
1 2.8687557 1.0000000
G 1
1 1.0459150 1.0000000
G 1
1 0.3689594 1.0000000
H 1
1 2.2659650 1.0000000
H 1
1 1.00115319 1.0000000
TIN
S 9
1 6214561.04195601 -0.0000684
2 1042616.87292139 -0.0004343
3 273207.6372098 -0.0018898
4 92366.29259856 -0.0057497
5 36320.2993689 -0.0176125
6 15519.24395975 -0.0418333
7 6892.76884554 -0.1201755
8 3066.91409025 -0.2662981
9 1356.76810858 -0.6326751
S 2
1 599.85670459 0.5467772
2 265.21383328 0.4830121
S 2
1 50.76024837 0.6784087
2 24.81906644 0.3422092
S 2
1 10.31910878 0.4765160
2 5.12658142 0.5456037
S 1
1 102.61176669 1.0000000
S 1
1 2.18073723 1.0000000
S 1
1 0.98815111 1.0000000
S 1
1 0.30368465 1.0000000
S 1
1 0.15149752 1.0000000
S 1
1 0.06361053 1.0000000
S 1
1 0.02690006 1.0000000
P 8
1 26272.29835062 0.0002428
2 6787.84104164 0.0017641
3 2457.14131177 0.0079431
4 1051.6938230 0.0278002
5 483.4455444 0.0855526
6 225.60685274 0.2231914
7 105.62800132 0.4073737
8 49.98597717 0.3935930
P 2
1 11.16249809 -0.7575462
2 5.50125855 -0.2712440
P 2
1 2.66797742 0.4935817
2 1.26434082 0.5479203
P 1
1 23.1008669 1.0000000
P 1
1 0.59145891 1.0000000
P 1
1 0.29074533 1.0000000
P 1
1 0.12136332 1.0000000
P 1
1 0.04751753 1.0000000
P 1
1 0.01269991 1.0000000
D 6
1 1047.7477620 0.0015127
2 313.88780705 0.0135966
3 121.47087193 0.0666480
4 51.95272666 0.2151199
5 23.10886649 0.4282453
6 10.4393598 0.4547301
D 1
1 4.70820428 1.0000000
D 1
1 2.11150671 1.0000000
D 1
1 0.89573825 1.0000000
D 1
1 0.14218067 1.0000000
D 1
1 0.04439991 1.0000000
F 1
1 3.8458875 1.0000000
F 1
1 1.4386541 1.0000000
F 1
1 0.5191905 1.0000000
F 1
1 0.18022573 1.0000000
G 1
1 3.0870987 1.0000000
G 1
1 1.1119276 1.0000000
G 1
1 0.32846958 1.0000000
H 1
1 2.5262121 1.0000000
H 1
1 1.050946271 1.0000000
ANTIMONY
S 9
1 10127007.98598542 0.0000524
2 1627020.64126192 0.0003372
3 410954.09946219 0.0016691
4 135270.89950648 0.0045352
5 52848.58293858 0.0167465
6 22654.11094468 0.0307939
7 9949.22211946 0.1215753
8 4392.50285006 0.2150400
9 1935.92226982 0.6904760
S 3
1 844.86233803 0.3957982
2 370.82335146 0.5258056
3 166.01213104 0.1270791
S 2
1 12.58376558 -0.3473176
2 6.2409214 -0.6726724
S 1
1 70.82547547 1.0000000
S 1
1 32.72789433 1.0000000
S 1
1 2.56717306 1.0000000
S 1
1 1.24714035 1.0000000
S 1
1 0.48806518 1.0000000
S 1
1 0.23042861 1.0000000
S 1
1 0.08659888 1.0000000
S 1
1 0.03499991 1.0000000
P 8
1 27907.23603808 0.0002386
2 7201.03079125 0.0017335
3 2611.83844042 0.0077821
4 1119.26879826 0.0272343
5 516.85774035 0.0829429
6 243.56354883 0.2153047
7 114.98961265 0.4016032
8 54.72219384 0.4076339
P 2
1 12.43305989 -0.7143855
2 6.17384562 -0.3166652
P 2
1 2.96569111 0.4670264
2 1.41416578 0.5734839
P 1
1 25.63021038 1.0000000
P 1
1 0.66294379 1.0000000
P 1
1 0.33073396 1.0000000
P 1
1 0.1449680 1.0000000
P 1
1 0.05872206 1.0000000
P 1
1 0.0150006 1.0000000
D 6
1 1137.92374557 0.0014217
2 341.64000968 0.0127845
3 132.81918865 0.0629342
4 57.09126506 0.2063283
5 25.51683423 0.4229995
6 11.58225167 0.4685602
D 1
1 5.27305301 1.0000000
D 1
1 2.38246993 1.0000000
D 1
1 1.02491896 1.0000000
D 1
1 0.22427111 1.0000000
D 1
1 0.06109991 1.0000000
F 1
1 4.0673126 1.0000000
F 1
1 1.5007223 1.0000000
F 1
1 0.5060578 1.0000000
F 1
1 0.1868314 1.0000000
G 1
1 3.2989987 1.0000000
G 1
1 1.1625019 1.0000000
G 1
1 0.35000999 1.0000000
H 1
1 2.8050167 1.0000000
H 1
1 1.10251191 1.0000000
TELLURIUM
S 8
1 10945103.32329198 -0.0001269
2 1849550.94525537 -0.0008412
3 511047.26306097 -0.0029276
4 173814.40768515 -0.0117886
5 64549.85103338 -0.0304092
6 26139.50704359 -0.1074308
7 11188.1789608 -0.2212161
8 4957.44116956 -0.7004639
S 2
1 2205.81230094 0.3274481
2 967.22526101 0.6988904
S 2
1 428.43445412 -0.7258096
2 195.71668887 -0.2968112
S 3
1 14.17578256 0.3223199
2 7.07345902 0.9476182
3 3.11438698 -0.3117598
S 1
1 80.68592685 1.0000000
S 1
1 37.12680085 1.0000000
S 1
1 1.54498092 1.0000000
S 1
1 0.72267241 1.0000000
S 1
1 0.27558954 1.0000000
S 1
1 0.10390784 1.0000000
S 1
1 0.03760011 1.0000000
P 8
1 29084.06552334 0.0002388
2 7499.84540096 0.0017367
3 2720.1865190 0.0077931
4 1166.12772545 0.0272573
5 539.25621036 0.0826933
6 254.86104555 0.2140202
7 120.64341081 0.4006270
8 57.52140139 0.4094482
P 2
1 13.13260498 -0.7177763
2 6.5339973 -0.3128998
P 2
1 3.13801445 0.4719917
2 1.50359784 0.5680975
P 1
1 27.02274269 1.0000000
P 1
1 0.70297651 1.0000000
P 1
1 0.35085319 1.0000000
P 1
1 0.15424056 1.0000000
P 1
1 0.06218389 1.0000000
P 1
1 0.0147012 1.0000000
D 6
1 1227.83930676 0.0013495
2 369.38039505 0.0121420
3 144.15939387 0.0599866
4 62.25430835 0.1989974
5 27.95222644 0.4181336
6 12.74556714 0.4802086
D 1
1 5.85248315 1.0000000
D 1
1 2.66085662 1.0000000
D 1
1 1.15851846 1.0000000
D 1
1 0.24968070 1.0000000
D 1
1 0.06550041 1.0000000
F 1
1 4.2066057 1.0000000
F 1
1 1.5196413 1.0000000
F 1
1 0.4431844 1.0000000
F 1
1 0.18951019 1.0000000
G 1
1 3.4120766 1.0000000
G 1
1 1.0976502 1.0000000
G 1
1 0.37363961 1.0000000
H 1
1 3.0924663 1.0000000
H 1
1 0.8055999 1.0000000
IODINE
S 8
1 14558870.36750702 -0.0001143
2 2459075.07453542 -0.0007542
3 649464.12317667 -0.0030152
4 212595.52228094 -0.0114690
5 79579.26400572 -0.0310776
6 32157.90615966 -0.1033772
7 13675.55867463 -0.2345391
8 6066.67486729 -0.6905194
S 2
1 2687.38520073 0.3170484
2 1173.02899848 0.7090906
S 2
1 93.12739355 0.2923981
2 43.0742010 0.7293532
S 3
1 19.26096071 -0.0306433
2 9.57385512 -0.7702298
3 4.6997524 -0.2178285
S 1
1 518.05165031 1.0000000
S 1
1 234.68149176 1.0000000
S 1
1 2.15922999 1.0000000
S 1
1 1.0240817 1.0000000
S 1
1 0.30881896 1.0000000
S 1
1 0.11887375 1.0000000
S 1
1 0.04339991 1.0000000
P 8
1 46407.33608726 0.0001298
2 11908.75993508 0.0009552
3 4275.69960832 0.0045134
4 1804.59086538 0.0165794
5 828.00592118 0.0540013
6 384.02504568 0.1618757
7 177.07702128 0.3732542
8 82.82828559 0.5142716
P 2
1 18.33771388 -0.5211480
2 8.96231469 -0.5172505
P 2
1 4.17282846 0.2919240
2 2.05522343 0.7383012
P 1
1 39.56191153 1.0000000
P 1
1 1.00115986 1.0000000
P 1
1 0.45367507 1.0000000
P 1
1 0.19245677 1.0000000
P 1
1 0.07569866 1.0000000
P 1
1 0.02299991 1.0000000
D 6
1 1375.40945759 0.0011819
2 424.69186119 0.0101496
3 167.70080001 0.0518038
4 71.93260292 0.1836358
5 32.10792431 0.4105234
6 14.63501363 0.5059903
D 1
1 6.78386002 1.0000000
D 1
1 3.0843887 1.0000000
D 1
1 1.34874013 1.0000000
D 1
1 0.35586811 1.0000000
D 1
1 0.08019991 1.0000000
F 1
1 4.56602539 1.0000000
F 1
1 1.662013195 1.0000000
F 1
1 0.4765312 1.0000000
F 1
1 0.2290821 1.0000000
G 1
1 3.36144369 1.0000000
G 1
1 0.8795537 1.0000000
G 1
1 0.39040098 1.0000000
H 1
1 3.3574080 1.0000000
H 1
1 0.73089989 1.0000000
XENON
S 11
1 14247295.52329023 -0.0000146
2 2420920.22071414 -0.0000894
3 678759.06832028 -0.0003427
4 230345.21063004 -0.0011976
5 85830.45624907 -0.0037121
6 34874.58796112 -0.0104924
7 14902.7162605 -0.0281134
8 6593.72587914 -0.0710996
9 2934.11295426 -0.1720677
10 1288.10080512 -0.3536629
11 568.50256561 -0.4716238
S 2
1 10.77229104 -0.7521923
2 5.34740003 -0.2648358
S 1
1 255.7053997 1.0000000
S 1
1 101.95252868 1.0000000
S 1
1 47.43782542 1.0000000
S 1
1 21.5450808 1.0000000
S 1
1 2.36939865 1.0000000
S 1
1 1.12964172 1.0000000
S 1
1 0.35114295 1.0000000
S 1
1 0.13589991 1.0000000
S 1
1 0.05449766 1.0000000
P 8
1 42524.53153965 0.0001582
2 10959.4019002 0.0011384
3 4030.32353105 0.0050535
4 1731.14794841 0.0183776
5 794.01485401 0.0595335
6 371.84342142 0.1700056
7 173.95097876 0.3764586
8 82.15536471 0.4973038
P 2
1 18.46267347 -0.5509351
2 9.09381209 -0.4865157
P 2
1 4.27945996 0.3226493
2 2.10768947 0.7094234
P 1
1 39.41840445 1.0000000
P 1
1 1.02952463 1.0000000
P 1
1 0.49039876 1.0000000
P 1
1 0.21111364 1.0000000
P 1
1 0.08461187 1.0000000
P 1
1 0.02399991 1.0000000
D 6
1 1378.38137139 0.0012905
2 415.31185801 0.0116295
3 162.67681021 0.0577101
4 70.60952497 0.1933699
5 31.88187814 0.4146718
6 14.6419455 0.4878888
D 1
1 6.80211758 1.0000000
D 1
1 3.14737392 1.0000000
D 1
1 1.40722911 1.0000000
D 1
1 0.56970867 1.0000000
D 1
1 0.173852993 1.0000000
F 1
1 4.93804389 1.0000000
F 1
1 1.810012095 1.0000000
F 1
1 0.525932697 1.0000000
F 1
1 0.18308697 1.0000000
G 1
1 3.49118699 1.0000000
G 1
1 0.78411339 1.0000000
G 1
1 0.39133664 1.0000000
H 1
1 3.66715789 1.0000000
H 1
1 0.87841188 1.0000000
View Git Blame Copy Permalink