!----------------------------------------------------------------------
! Basis Set Exchange
! Version 0.11
! https://www.basissetexchange.org
!----------------------------------------------------------------------
! Basis set: def2-SVPD
! Description: def2-SVPD
! Role: orbital
! Version: 1 (Data from Turbomole 7.3)
!----------------------------------------------------------------------
-H 0
S 3 1.00
13.0107010 0.19682158D-01
1.9622572 0.13796524
0.44453796 0.47831935
S 1 1.00
0.12194962 1.0000000
P 1 1.00
0.8000000 1.0000000
P 1 1.00
0.11704099050 1.0000000
****
-He 0
S 3 1.00
38.354936737 0.23814288905D-01
5.7689081479 0.15490906777
1.2399407035 0.46998096633
S 1 1.00
0.29757815953 1.0000000
P 1 1.00
1.0000000 1.0000000
P 1 1.00
0.22039119441 1.0000000
****
-Li 0
S 5 1.00
266.27785516 0.64920150325D-02
40.069783447 0.47747863215D-01
9.0559944389 0.20268796111
2.4503009051 0.48606574817
0.72209571855 0.43626977955
S 1 1.00
0.52810884721D-01 1.0000000
S 1 1.00
0.20960948798D-01 1.0000000
P 2 1.00
1.4500000 0.2586000
0.3000000 1.0000000
P 1 1.00
0.0820000 1.0000000
P 1 1.00
0.26347662457D-01 1.0000000
****
-Be 0
S 5 1.00
515.18616125 0.55615307983D-02
77.511037595 0.41190068062D-01
17.552481693 0.17913378108
4.8028940596 0.44736716455
1.4516214316 0.42009581920
S 1 1.00
0.13281633620 1.0000000
S 1 1.00
0.45837372213D-01 1.0000000
P 3 1.00
3.6316917145 -0.29033998305D-01
0.71695694366 -0.16877854032
0.19541932860 -0.51403419628
P 1 1.00
0.60515465890D-01 1.0000000
P 1 1.00
0.30181880660D-01 1.0000000
****
-B 0
S 5 1.00
839.31830086 -0.55929201074D-02
126.26464843 -0.41565520771D-01
28.620600763 -0.18299816983
7.8793722710 -0.46540391866
2.4088857172 -0.44173884791
S 1 1.00
0.25105109036 1.0000000
S 1 1.00
0.83648866069D-01 1.0000000
S 1 1.00
0.42351565332D-01 1.0000000
P 3 1.00
6.0332223619 -0.35603672456D-01
1.2499157866 -0.19895775769
0.33871676350 -0.50850202618
P 1 1.00
0.96415632351D-01 1.0000000
D 1 1.00
0.5000000 1.0000000
D 1 1.00
0.74392443101D-01 1.0000000
****
-C 0
S 5 1.00
1238.4016938 0.54568832082D-02
186.29004992 0.40638409211D-01
42.251176346 0.18025593888
11.676557932 0.46315121755
3.5930506482 0.44087173314
S 1 1.00
0.40245147363 1.0000000
S 1 1.00
0.13090182668 1.0000000
S 1 1.00
0.67053540256D-01 1.0000000
P 3 1.00
9.4680970621 0.38387871728D-01
2.0103545142 0.21117025112
0.54771004707 0.51328172114
P 1 1.00
0.15268613795 1.0000000
D 1 1.00
0.8000000 1.0000000
D 1 1.00
0.11713185140 1.0000000
****
-N 0
S 5 1.00
1712.8415853 -0.53934125305D-02
257.64812677 -0.40221581118D-01
58.458245853 -0.17931144990
16.198367905 -0.46376317823
5.0052600809 -0.44171422662
S 1 1.00
0.58731856571 1.0000000
S 1 1.00
0.18764592253 1.0000000
S 1 1.00
0.96171241529D-01 1.0000000
P 3 1.00
13.571470233 -0.40072398852D-01
2.9257372874 -0.21807045028
0.79927750754 -0.51294466049
P 1 1.00
0.21954348034 1.0000000
D 1 1.00
1.0000000 1.0000000
D 1 1.00
0.16697708112 1.0000000
****
-O 0
S 5 1.00
2266.1767785 -0.53431809926D-02
340.87010191 -0.39890039230D-01
77.363135167 -0.17853911985
21.479644940 -0.46427684959
6.6589433124 -0.44309745172
S 1 1.00
0.80975975668 1.0000000
S 1 1.00
0.25530772234 1.0000000
S 1 1.00
0.76572453250D-01 1.0000000
P 3 1.00
17.721504317 0.43394573193D-01
3.8635505440 0.23094120765
1.0480920883 0.51375311064
P 1 1.00
0.27641544411 1.0000000
P 1 1.00
0.69002276350D-01 1.0000000
D 1 1.00
1.2000000 1.0000000
D 1 1.00
0.17992024323 1.0000000
****
-F 0
S 5 1.00
2894.8325990 -0.53408255515D-02
435.41939120 -0.39904258866D-01
98.843328866 -0.17912768038
27.485198001 -0.46758090825
8.5405498171 -0.44653131020
S 1 1.00
1.0654578038 1.0000000
S 1 1.00
0.33247346748 1.0000000
S 1 1.00
0.98097752264D-01 1.0000000
P 3 1.00
22.696633924 -0.45212874436D-01
4.9872339257 -0.23754317067
1.3491613954 -0.51287353587
P 1 1.00
0.34829881977 1.0000000
P 1 1.00
0.83372148304D-01 1.0000000
D 1 1.00
1.4000000 1.0000000
D 1 1.00
0.22301361948 1.0000000
****
-Ne 0
S 5 1.00
3598.9736625 -0.53259297003D-02
541.32073112 -0.39817417969D-01
122.90450062 -0.17914358188
34.216617022 -0.46893582977
10.650584124 -0.44782537577
S 1 1.00
1.3545953960 1.0000000
S 1 1.00
0.41919362639 1.0000000
S 1 1.00
0.12055043545 1.0000000
P 3 1.00
28.424053785 -0.46031944795D-01
6.2822510953 -0.23993183041
1.6978715079 -0.50871724964
P 1 1.00
0.43300700172 1.0000000
P 1 1.00
0.10141942051 1.0000000
D 1 1.00
1.8880000 1.0000000
D 1 1.00
0.28026803041 1.0000000
****
-Na 0
S 5 1.00
4098.2003908 -0.58535911879D-02
616.49374031 -0.43647161872D-01
139.96644001 -0.19431465884
39.073441051 -0.48685065731
11.929847205 -0.41881705137
S 3 1.00
20.659966030 0.85949689854D-01
1.9838860978 -0.56359144041
0.64836323942 -0.51954009048
S 1 1.00
0.52443967404D-01 1.0000000
S 1 1.00
0.28048160742D-01 1.0000000
P 5 1.00
75.401862017 0.154353625324D-01
17.274818978 0.997382931840D-01
5.1842347425 0.312095939659
1.6601211973 0.492956748074
0.51232528958 0.324203983180
P 1 1.00
0.0520000 1.0000000
P 1 1.00
0.19853008514D-01 1.0000000
D 1 1.00
0.1310000 1.0000000
****
-Mg 0
S 5 1.00
4953.8339196 -0.57778967498D-02
745.18044154 -0.43124761082D-01
169.21604972 -0.19268216987
47.300672019 -0.48641439116
14.461336973 -0.42550894077
S 3 1.00
24.768174789 0.87956969984D-01
2.4940945349 -0.55165058128
0.87807584533 -0.53443294833
S 1 1.00
0.87212782497D-01 1.0000000
S 1 1.00
0.33599293780D-01 1.0000000
P 5 1.00
98.053010494 -0.14480564601D-01
22.586932277 -0.95495750787D-01
6.8391509842 -0.30787672651
2.2332843818 -0.49936292886
0.71606599387 -0.31503476213
P 1 1.00
0.18914796195 1.0000000
P 1 1.00
0.53768755187D-01 1.0000000
P 1 1.00
0.23963578287D-01 1.0000000
D 1 1.00
0.1010000 1.0000000
****
-Al 0
S 5 1.00
5887.5727030 0.13483347987D-02
885.61225996 0.10071576809D-01
201.13604899 0.45132454056D-01
56.284974674 0.11461268043
17.229551243 0.10159608943
S 3 1.00
29.340249922 0.69347454208D-01
3.0439630420 -0.42528117679
1.1285539518 -0.41449832210
S 1 1.00
0.14234175160 1.0000000
S 1 1.00
0.54400192313D-01 1.0000000
S 1 1.00
0.32535359511D-01 1.0000000
P 5 1.00
145.11918809 0.63963373134D-02
33.717894833 0.44189359965D-01
10.369863083 0.15581575993
3.5135616036 0.28635286951
1.1980050273 0.22921423248
P 1 1.00
0.26583005913 1.0000000
P 1 1.00
0.71003361994D-01 1.0000000
D 1 1.00
0.3000000 1.0000000
D 1 1.00
0.53071685831D-01 1.0000000
****
-Si 0
S 5 1.00
6903.7118686 0.13373962995D-02
1038.4346419 0.99966546241D-02
235.87581480 0.44910165101D-01
66.069385169 0.11463638540
20.247945761 0.10280063858
S 3 1.00
34.353481730 0.70837285010D-01
3.6370788192 -0.43028836252
1.4002048599 -0.41382774969
S 1 1.00
0.20484414805 1.0000000
S 1 1.00
0.77994095468D-01 1.0000000
S 1 1.00
0.46834778282D-01 1.0000000
P 5 1.00
179.83907373 0.61916656462D-02
41.907258846 0.43399431982D-01
12.955294367 0.15632019351
4.4383267393 0.29419996982
1.5462247904 0.23536823814
P 1 1.00
0.35607612302 1.0000000
P 1 1.00
0.10008513762 1.0000000
D 1 1.00
0.3500000 1.0000000
D 1 1.00
0.74117707708D-01 1.0000000
****
-P 0
S 5 1.00
8002.4795106 0.57503489302D-02
1203.6813590 0.43007628959D-01
273.44227031 0.19363986252
76.655541517 0.49651693399
23.516927435 0.44983262479
S 3 1.00
39.791683439 0.95188129789D-01
4.2770343323 -0.57649840368
1.6940256888 -0.54239583865
S 1 1.00
0.27567674644 1.0000000
S 1 1.00
0.10495590099 1.0000000
S 1 1.00
0.64309734755D-01 1.0000000
P 5 1.00
219.50755823 0.92100565257D-02
51.274155030 0.65409765745D-01
15.921595892 0.24033730279
5.5069913481 0.46318321788
1.9537719426 0.37392563382
P 1 1.00
0.47803397932 1.0000000
P 1 1.00
0.13657952621 1.0000000
D 1 1.00
0.4500000 1.0000000
D 1 1.00
0.99587311089D-01 1.0000000
****
-S 0
S 5 1.00
9184.9303010 -0.22294387756D-02
1381.5105503 -0.16683029937D-01
313.87147580 -0.75262436116D-01
88.053870623 -0.19376827038
27.039914905 -0.17718020803
S 3 1.00
45.648731303 -0.10736062573
4.9664522326 0.65066293018
2.0116242047 0.59712155354
S 1 1.00
0.35661077013 1.0000000
S 1 1.00
0.13507221477 1.0000000
S 1 1.00
0.44999823506D-01 1.0000000
P 5 1.00
261.98233439 -0.92729929822D-02
61.306894736 -0.66547669241D-01
19.103729887 -0.24828595903
6.6567720378 -0.48703847402
2.3959635161 -0.39337850312
P 1 1.00
0.61776161679 1.0000000
P 1 1.00
0.16993376871 1.0000000
P 1 1.00
0.41706793676D-01 1.0000000
D 1 1.00
0.5500000 1.0000000
D 1 1.00
0.10172853717 1.0000000
****
-Cl 0
S 5 1.00
10449.8275660 0.19708362484D-02
1571.7365221 0.14754727977D-01
357.12065523 0.66679112875D-01
100.25185935 0.17228924084
30.812727554 0.15883786100
S 3 1.00
51.923789434 -0.10009298909
5.7045760975 0.60841752753
2.3508376809 0.54352153355
S 1 1.00
0.44605124672 1.0000000
S 1 1.00
0.16848856190 1.0000000
S 1 1.00
0.55344229413D-01 1.0000000
P 5 1.00
307.66790569 -0.87801484118D-02
72.102015515 -0.63563355471D-01
22.532680262 -0.24016428276
7.8991765444 -0.47798866557
2.8767268321 -0.38515850005
P 1 1.00
0.77459363955 1.0000000
P 1 1.00
0.21037699698 1.0000000
P 1 1.00
0.50046271086D-01 1.0000000
D 1 1.00
0.6500000 1.0000000
D 1 1.00
0.12284803390 1.0000000
****
-Ar 0
S 5 1.00
11797.1197650 0.20214479973D-02
1774.3522753 0.15139852688D-01
403.18875733 0.68525400873D-01
113.24933999 0.17762929207
34.835298193 0.16496495001
S 3 1.00
58.614775042 -0.10343394000
6.4922045078 0.63133365899
2.7117014403 0.54887572301
S 1 1.00
0.54412974538 1.0000000
S 1 1.00
0.20517411136 1.0000000
S 1 1.00
0.66442487045D-01 1.0000000
P 5 1.00
356.28707256 -0.87321783271D-02
83.593132866 -0.63680317444D-01
26.186704029 -0.24311906886
9.2257275925 -0.48956069653
3.3922754954 -0.39229190040
P 1 1.00
0.94740534010 1.0000000
P 1 1.00
0.25659135062 1.0000000
P 1 1.00
0.59491455142D-01 1.0000000
D 1 1.00
0.6960000 1.0000000
D 1 1.00
0.14309493859 1.0000000
****
-K 0
S 6 1.00
31478.7467640 0.39838653994D-02
4726.8876066 0.30501759762D-01
1075.4345353 0.15073752622
303.39811023 0.51912939801
98.327112831 1.0366957005
33.636222177 0.76398963199
S 3 1.00
65.639209962 -0.28242617106
7.3162592218 1.6914935860
2.8902580135 1.2965331953
S 3 1.00
4.5459748965 -0.76343555273D-02
0.70404124062 0.25635718960D-01
0.28266888959 0.16606859208D-01
S 1 1.00
0.29058164020D-01 1.0000000
S 1 1.00
0.12111638157D-01 1.0000000
P 5 1.00
361.22492154 0.20906479823D-01
84.670222166 0.15043641740
26.469088236 0.55440061077
9.2658077615 1.0409009991
3.3423388293 0.67825341194
P 3 1.00
1.5100876104 0.75248191146
0.56568375163 1.3708585031
0.20817008495 0.66047633079
P 1 1.00
0.0417370 1.0000000
P 1 1.00
0.16603217986D-01 1.0000000
D 1 1.00
0.3530000 1.0000000
D 1 1.00
0.0980000 1.0000000
****
-Ca 0
S 6 1.00
35138.7139290 0.39482520740D-02
5276.4111348 0.30234243552D-01
1200.4692589 0.14952019681
338.71810542 0.51597345713
109.85385922 1.0339510296
37.608880299 0.76937933526
S 3 1.00
73.107977555 -0.28268525011
8.2407705688 1.6796092142
3.2959812993 1.2803766016
S 3 1.00
5.2341800914 -0.76868604561D-02
0.84187220515 0.25382375978D-01
0.36510294029 0.16512171511D-01
S 1 1.00
0.51222402884D-01 1.0000000
S 1 1.00
0.19825111408D-01 1.0000000
P 5 1.00
413.11313893 0.20327135354D-01
96.935786224 0.14730276362
30.372154659 0.54887167322
10.684776830 1.0440659818
3.8821258350 0.68653490684
P 3 1.00
1.7993016295 0.75410246871
0.69189056530 1.3409296599
0.26364024096 0.56391989435
P 1 1.00
0.0749790 1.0000000
P 1 1.00
0.23809355789D-01 1.0000000
D 3 1.00
5.4979093879 0.73770011433D-01
1.3177128032 0.26052853169
0.32188682649 0.45233836380
D 1 1.00
0.70528614919D-01 1.0000000
****
-Sc 0
S 6 1.00
38956.0818040 0.39293205858D-02
5849.5733637 0.30093221229D-01
1330.8813154 0.14890370950
375.55534165 0.51464282906
121.87261370 1.0337708070
41.760243729 0.77436851627
S 3 1.00
81.060633953 -0.28318552316
9.2059823972 1.6770806984
3.7063215732 1.2594733678
S 3 1.00
5.9888909988 -0.77821367493D-02
0.97363432378 0.25499692745D-01
0.42041019223 0.16191560820D-01
S 1 1.00
0.59440551913D-01 1.0000000
S 1 1.00
0.22897806303D-01 1.0000000
P 5 1.00
466.31481262 0.19984300385D-01
109.51217097 0.14561043072
34.375921827 0.54687466223
12.142096955 1.0479006012
4.4336767669 0.68894890327
P 3 1.00
2.0971291866 0.75619214724
0.80977606956 1.3178212235
0.30834046588 0.54312268173
P 1 1.00
0.0897480 1.0000000
P 1 1.00
0.28148150384D-01 1.0000000
D 4 1.00
19.240334928 0.27039082144D-01
5.1178995899 0.13803684743
1.6554278827 0.34869086403
0.54016355610 0.48594185717
D 1 1.00
0.16211214518 .34374449689
F 1 1.00
0.3450000 1.0000000
****
-Ti 0
S 6 1.00
42961.5121850 0.39127635355D-02
6450.9759169 0.29969820489D-01
1467.7210915 0.14836352707
414.20997355 0.51347285324
134.48715840 1.0335365483
46.122209796 0.77854233930
S 3 1.00
89.447762543 -0.28385401259
10.223346060 1.6772785333
4.1353774271 1.2411928456
S 3 1.00
6.7896181452 -0.78399994518D-02
1.1106730691 0.25495493019D-01
0.47565975578 0.16061172892D-01
S 1 1.00
0.65986956934D-01 1.0000000
S 1 1.00
0.25210342250D-01 1.0000000
P 5 1.00
522.03684782 0.19754179642D-01
122.68649489 0.14460677619
38.572903611 0.54669004165
13.672169319 1.0531647540
5.0118529359 0.69111213363
P 3 1.00
2.4131928282 0.75803437136
0.93252270050 1.3036241399
0.35429058390 0.53638653300
P 1 1.00
0.1015610 1.0000000
P 1 1.00
0.35788253200D-01 1.0000000
D 4 1.00
23.465125957 0.26536380115D-01
6.3332593832 0.13796453963
2.0766489946 0.35312644228
0.69027361954 0.48647124166
D 1 1.00
0.21088738554 .33026314258
F 1 1.00
0.5620000 1.0000000
****
-V 0
S 6 1.00
47160.3760600 0.14498688908D-02
7081.4110871 0.11106435251D-01
1611.1621223 0.55005423585D-01
454.72940551 0.19060252591
147.71321208 0.38435022957
50.699538950 0.29095546792
S 3 1.00
98.262492669 -0.10942337856
11.294293099 0.64539490399
4.5853360105 0.47117880777
S 3 1.00
7.6359689588 -0.22454949054
1.2539836689 0.72594852764
0.53271935387 0.45560582748
S 1 1.00
0.72246239566D-01 1.0000000
S 1 1.00
0.27358087448D-01 1.0000000
P 5 1.00
580.55044988 0.97315110917D-02
136.52341127 0.71531241137D-01
42.983958820 0.27197688414
15.282798763 0.52618988893
5.6202495154 0.34452533498
P 3 1.00
2.7485386415 0.34040396496
1.0618550073 0.57983996120
0.40235518645 0.23911643083
P 1 1.00
0.1112480 1.0000000
P 1 1.00
0.35000888460D-01 1.0000000
D 4 1.00
27.358434017 0.26641927050D-01
7.4540604253 0.13995311726
2.4633917847 0.35751066639
0.82480925277 0.48488354148
D 1 1.00
0.25257904742 .32332844995
F 1 1.00
0.8310000 1.0000000
****
-Cr 0
S 6 1.00
51528.0863490 0.14405823106D-02
7737.2103487 0.11036202287D-01
1760.3748470 0.54676651806D-01
496.87706544 0.18965038103
161.46520598 0.38295412850
55.466352268 0.29090050668
S 3 1.00
107.54732999 -0.10932281100
12.408671897 0.64472599471
5.0423628826 0.46262712560
S 3 1.00
8.5461640165 -0.22711013286
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0.28250687604D-01 1.0000000
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640.48536096 0.96126715203D-02
150.69711194 0.70889834655D-01
47.503755296 0.27065258990
16.934120165 0.52437343414
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27.559479426 0.30612488044D-01
7.4687020327 0.15593270944
2.4345903574 0.36984421276
0.78244754808 0.47071118077
D 1 1.00
0.21995774311 .33941649889
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1.1470000 1.0000000
****
-Mn 0
S 6 1.00
56137.0090370 0.14321304702D-02
8429.2063943 0.10972509162D-01
1917.8277233 0.54382468712D-01
541.36230198 0.18884335129
176.00069142 0.38198025054
60.500477010 0.29156772596
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117.17282882 -0.10933661328
13.596973368 0.64305039431
5.5483996341 0.45848970584
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0.65230205868 0.45300721536
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706.00497535 0.95055518167D-02
166.19728820 0.70356271142D-01
52.452061906 0.27005556982
18.746932862 0.52574344602
6.9282991622 0.34254033223
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3.4772204938 0.33994073736
1.3406906449 0.57203836254
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35.423264935 0.26985304111D-01
9.7814221451 0.14383458648
3.2673488767 0.36418958377
1.1026472189 0.48152670661
D 1 1.00
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1.3260000 1.0000000
****
-Fe 0
S 6 1.00
60923.6406430 0.14302254466D-02
9147.8893982 0.10958790038D-01
2081.3505927 0.54332554248D-01
587.55977067 0.18884995009
191.09043990 0.38253069946
65.732730112 0.29308335984
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127.25891928 -0.10964564925
14.830913010 0.64387631332
6.0653307408 0.45472347323
S 3 1.00
10.449943710 -0.22539639952
1.7245228003 0.72164398156
0.71772177325 0.44985492922
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773.43750995 0.94325735144D-02
182.15149714 0.70029620575D-01
57.547272758 0.26993651996
20.614988935 0.52700011047
7.6348557890 0.34284148028
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3.8719327990 0.33974402988
1.4924724132 0.56842594005
0.56061284958 0.23649365839
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0.1349150 1.0000000
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0.36933633962D-01 1.0000000
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38.968133419 0.27879664382D-01
10.800067078 0.14858319982
3.6136457999 0.36905479496
1.2129967888 0.47745100883
D 1 1.00
0.36524393170 .31418142304
F 1 1.00
1.5980000 1.0000000
****
-Co 0
S 6 1.00
65902.2082570 0.14284614936D-02
9895.3896027 0.10946072783D-01
2251.4305789 0.54285953890D-01
635.61097084 0.18885179079
206.78820681 0.38301634994
71.179242971 0.29443551266
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137.77268040 -0.10990221736
16.118079243 0.64455537395
6.6030327710 0.45116787924
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11.479915788 -0.22593846910
1.8956426324 0.72231409008
0.78466232067 0.44903812296
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843.64358575 0.93866097254D-02
198.76386994 0.69880208716D-01
62.854963098 0.27037070345
22.562842280 0.52904786880
8.3713209127 0.34357029579
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4.2858719800 0.34027999036
1.6508041817 0.56693392384
0.61834231096 0.23617979783
P 1 1.00
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P 1 1.00
0.37744197011D-01 1.0000000
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42.927867612 0.28487788365D-01
11.942533053 0.15206951283
4.0046495664 0.37310913999
1.3413193804 0.47549837676
D 1 1.00
0.40015009743 .31346831424
F 1 1.00
1.9030000 1.0000000
****
-Ni 0
S 6 1.00
71074.8032110 0.14260386729D-02
10672.0209410 0.10928236994D-01
2428.1389007 0.54212626938D-01
685.53595148 0.18874768902
223.10072863 0.38324616985
76.842014042 0.29550637144
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148.71122016 -0.11014443059
17.459154987 0.64521426988
7.1625280665 0.44797838103
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12.556137125 -0.22645403224
2.0735740488 0.72320959286
0.85382640602 0.44868026476
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0.10536766271 1.0000000
S 1 1.00
0.38134087688D-01 1.0000000
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916.73608662 0.93439635610D-02
216.06139913 0.69737374902D-01
68.383914817 0.27073495012
24.593843952 0.53078301549
9.1392960204 0.34410229438
P 3 1.00
4.7193371746 0.34076082016
1.8161849234 0.56580169611
0.67840750720 0.23616717361
P 1 1.00
0.1465880 1.0000000
P 1 1.00
0.38905548722D-01 1.0000000
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47.093832108 0.28982316948D-01
13.146463975 0.15494995950
4.4170548925 0.37633115111
1.4771565078 0.47365096014
D 1 1.00
0.43735921792 .31247837833
F 1 1.00
2.1740000 1.0000000
****
-Cu 0
S 6 1.00
76381.3480560 0.14336079896D-02
11468.7774990 0.10986749865D-01
2609.4246495 0.54513652465D-01
736.75033098 0.18990128258
239.82419958 0.38581959211
82.656829252 0.29790607498
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160.13544196 -0.11146778567
18.834177695 0.65349301031
7.7176595741 0.44770534421
S 3 1.00
13.710846717 -0.22870911122
2.2349895670 0.73464423031
0.87818360069 0.43273070874
S 1 1.00
0.87187458064D-01 1.0000000
S 1 1.00
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991.24075782 0.93878498798D-02
233.69376116 0.70208282458D-01
74.020930927 0.27323522220
26.664967447 0.53580792728
9.9192087478 0.34575794906
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5.1519553926 0.34229108083
1.9638205828 0.56456592484
0.71560097037 0.24078584318
P 1 1.00
0.1550650 1.0000000
P 1 1.00
0.38734214974D-01 1.0000000
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47.335049590 0.32375547758D-01
13.161666077 0.16810218684
4.3693777244 0.38477707982
1.4132925109 0.46147880178
D 1 1.00
0.38878001452 .32388873258
F 1 1.00
2.2330000 1.0000000
****
-Zn 0
S 6 1.00
82000.7116290 0.14210764000D-02
12312.4717770 0.10891499487D-01
2801.3944193 0.54057188059D-01
790.99424302 0.18847463904
257.56551079 0.38346549346
88.814933400 0.29723794197
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171.86353716 -0.11051849523
20.302534785 0.64607716984
8.3464123068 0.44220117322
S 3 1.00
14.847536940 -0.22705309278
2.4495029507 0.72433217935
0.99845821824 0.44836495592
S 1 1.00
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S 1 1.00
0.42297428760D-01 1.0000000
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1071.5185372 0.92767797235D-02
252.69712152 0.69541149434D-01
80.100829126 0.27156772564
28.903393172 0.53401355573
10.768899879 0.34501323446
P 3 1.00
5.6446212530 0.34129600164
2.1678291347 0.56390521973
0.80540898341 0.23676109735
P 1 1.00
0.1624550 1.0000000
P 1 1.00
0.42022716037D-01 1.0000000
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56.088939191 0.29588869140D-01
15.751908917 0.158725714045
5.3115812367 0.379762291591
1.7737904917 0.468989591719
D 1 1.00
0.51975583665 .309071490776
F 1 1.00
2.6140000 1.0000000
****
-Ga 0
S 6 1.00
87842.1262960 0.14271588798D-02
13189.4964020 0.10938894097D-01
3000.9482141 0.54308200127D-01
847.38425966 0.18951055983
276.00980642 0.38615185918
95.216672071 0.30051082719
S 3 1.00
184.00703968 -0.11124461963
21.827051433 0.64831322918
9.0026963761 0.44358383594
S 3 1.00
16.033176938 -0.23014299555
2.6707724878 0.72946861516
1.1252834170 0.46214976951
S 1 1.00
0.15967608829 1.0000000
S 1 1.00
0.57643044753D-01 1.0000000
S 1 1.00
0.31819812628D-01 1.0000000
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1167.2665844 0.90974021307D-02
275.38062789 0.68456273343D-01
87.375073070 0.26922293888
31.597254670 0.53507897882
11.824122798 0.35279062760
P 3 1.00
6.2881845133 0.33938244530
2.5199853240 0.56871947608
1.0169726306 0.27717694939
P 1 1.00
0.24748373604 1.0000000
P 1 1.00
0.66685294163D-01 1.0000000
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65.354237674 0.27370146382D-01
18.504656747 0.15099463976
6.3179620632 0.37485328545
2.1641389426 0.47510606851
D 1 1.00
0.66693092754 .29843287401
D 1 1.00
0.2070000 1.0000000
D 1 1.00
0.49799390975D-01 1.0000000
****
-Ge 0
S 6 1.00
93889.8366420 0.14233976060D-02
14097.4975280 0.10910795654D-01
3207.5477309 0.54183705943D-01
905.76727269 0.18922820349
295.11014693 0.38612847001
101.84713141 0.30164050736
S 3 1.00
196.56719662 -0.11118770940
23.405292522 0.64616007369
9.6839116702 0.44188904568
S 3 1.00
17.269736544 -0.23027421375
2.8964622160 0.73017169398
1.2553621412 0.46197222255
S 1 1.00
0.20213081492 1.0000000
S 1 1.00
0.73867910982D-01 1.0000000
S 1 1.00
0.43410224935D-01 1.0000000
P 5 1.00
1259.2085995 0.90115464252D-02
297.15626382 0.67986841689D-01
94.353387522 0.26853856488
34.176329677 0.53659649219
12.816139615 0.35633514961
P 3 1.00
6.8471029784 0.33900693119
2.7717363939 0.56809365264
1.1458418175 0.27246539884
P 1 1.00
0.30679631536 1.0000000
P 1 1.00
0.89283644115D-01 1.0000000
D 4 1.00
74.782168177 0.25755860205D-01
21.310849759 0.14536816132
7.3464792363 0.37134209859
2.5656271395 0.48002998436
D 1 1.00
0.81981773070 .28978790744
D 1 1.00
0.2460000 1.0000000
D 1 1.00
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****
-As 0
S 6 1.00
100146.5255400 0.14258349617D-02
15036.8617110 0.10930176963D-01
3421.2902833 0.54294174610D-01
966.16965717 0.18976078153
314.87394026 0.38775195453
108.70823790 0.30402812040
S 3 1.00
209.54238950 -0.11162094204
25.038221139 0.64697607762
10.390964343 0.44223608673
S 3 1.00
18.555090093 -0.22994190569
3.1281217449 0.73319107613
1.3884885073 0.45533653943
S 1 1.00
0.24714362141 1.0000000
S 1 1.00
0.91429428670D-01 1.0000000
S 1 1.00
0.55939685220D-01 1.0000000
P 5 1.00
1355.6443507 0.89182507898D-02
319.99929270 0.67454750717D-01
101.67734092 0.26759772110
36.886323845 0.53776844520
13.861115909 0.35992570244
P 3 1.00
7.4260666912 0.34036849637
3.0316247187 0.57030149334
1.2783078340 0.26606170238
P 1 1.00
0.37568503356 1.0000000
P 1 1.00
0.11394805454 1.0000000
D 4 1.00
84.445514539 0.24518402724D-01
24.190416102 0.14107454677
8.4045015119 0.36875228915
2.9808970748 0.48409561362
D 1 1.00
0.97909243359 .28250268781
D 1 1.00
0.2930000 1.0000000
D 1 1.00
0.84097628016D-01 1.0000000
****
-Se 0
S 6 1.00
106612.2002700 0.14274889113D-02
16007.6047010 0.10943525114D-01
3642.1699707 0.54374171596D-01
1028.5912993 0.19018092947
335.30298888 0.38913021696
115.80129154 0.30620207088
S 3 1.00
222.93325020 -0.11198808009
26.726257934 0.64752124207
11.124501923 0.44241976651
S 3 1.00
19.888520061 -0.22857227762
3.3668473803 0.73591359951
1.5249277839 0.44330199577
S 1 1.00
0.29630037912 1.0000000
S 1 1.00
0.11009288974 1.0000000
S 1 1.00
0.42167294728D-01 1.0000000
P 5 1.00
1455.9068120 0.88203597043D-02
343.75101831 0.66875851967D-01
109.29554964 0.26640578080
39.707711022 0.53834928422
14.950185232 0.36303281993
P 3 1.00
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3.2934649756 0.57257906583
1.4058602438 0.25549813222
P 1 1.00
0.45076123226 1.0000000
P 1 1.00
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P 1 1.00
0.34396697938D-01 1.0000000
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94.494024044 0.23490101098D-01
27.188185260 0.13747735767D+00
9.5091567352 0.36649929124D+00
3.4170516853 0.48750989884D+00
D 1 1.00
1.1479590083 .27657943383D+00
D 1 1.00
0.3380000 1.0000000
D 1 1.00
0.82767380906D-01 1.0000000
****
-Br 0
S 6 1.00
113286.3877600 0.14283037779D-02
17009.6263030 0.10950417496D-01
3870.1842567 0.54421006604D-01
1093.0357227 0.19047907695
356.39721797 0.39024642737
123.12539643 0.30814432514
S 3 1.00
236.74084007 -0.11228065671
28.468661070 0.64775962312
11.883443722 0.44235575986
S 3 1.00
21.269633312 -0.22642576323
3.6129226841 0.73823712008
1.6626648969 0.42683868694
S 1 1.00
0.34823793232 1.0000000
S 1 1.00
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0.50966709763D-01 1.0000000
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1560.2801881 0.87166669072D-02
368.47859205 0.66243637420D-01
117.22978849 0.26495610385
42.648909248 0.53839160587
16.087225096 0.36579387888
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8.6352810058 0.34248787366
3.5613665502 0.57500678213
1.5292626609 0.24330394172
P 1 1.00
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P 1 1.00
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P 1 1.00
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104.85518642 0.22650147581D-01
30.281143688 0.13455483230
10.651394267 0.36474454537
3.8699456233 0.49044587056
D 1 1.00
1.3240876762 .27137289040
D 1 1.00
0.3890000 1.0000000
D 1 1.00
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****
-Kr 0
S 6 1.00
120165.6487500 0.14294234496D-02
18042.5001690 0.10959597020D-01
4105.1800388 0.54479647470D-01
1159.4447248 0.19081239122
378.13810346 0.39140445949
130.67610045 0.31007346689
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250.96373353 -0.11258604011
30.265930380 0.64816322524
12.668110757 0.44240238994
S 3 1.00
22.697940101 -0.22391964908
3.8673017398 0.74060953026
1.8013706671 0.40803658445
S 1 1.00
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S 1 1.00
0.60450731670D-01 1.0000000
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1668.5736623 0.86215009803D-02
394.13862798 0.65665506884D-01
125.46644854 0.26366576697
45.704992729 0.53867658574
17.270133229 0.36865167502
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9.2699487770 0.34346189015
3.8364617719 0.57784776196
1.6467163312 0.23075615197
P 1 1.00
0.61479686489 1.0000000
P 1 1.00
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115.55868603 0.21945485333D-01
33.477985864 0.13211212879
11.834450207 0.36333306964
4.3408254894 0.49300484446
D 1 1.00
1.5079273157 .26676858913
D 1 1.00
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D 1 1.00
0.11235044486 1.0000000
****
-Rb 0
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0.45147933555 1.0000000
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2.9442428420 -0.67740090428
0.58171262989 0.45712389487
S 1 1.00
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5.5234179480 0.51234729472D-01
3.4120149646 -0.17337025646
0.76899021792 0.43339683188
0.33088071786 0.55354332721
P 1 1.00
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P 1 1.00
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P 1 1.00
0.43243763156D-02 1.0000000
D 1 1.00
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D 1 1.00
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****
-Sr 0
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5.9276428767 0.19698765364
3.0691274814 -0.64852205985
0.70675488028 0.62064729022
S 1 1.00
0.33824024280 1.0000000
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1.6642340000 0.37856824234
0.59455471858 0.59874487803
0.26152621998 0.35314019512
P 1 1.00
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P 1 1.00
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3.6180810000 -0.75010000000D-02
0.99665600000 0.10809800000
0.39073500000 0.27854000000
0.12277000000 0.47731800000
D 1 1.00
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****
-Y 0
S 3 1.00
5.1329580000 -1.3864845457
4.2401920000 1.9459581166
1.2982800000 0.44182603154
S 1 1.00
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1.9790500000 0.32572065995957
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0.38409397354 0.44385929492812
P 1 1.00
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P 1 1.00
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P 1 1.00
0.0300000 1.0000000
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0.98100000000D-01 1.0000000
P 1 1.00
0.0431000 1.0000000
D 4 1.00
3.9738796278 -0.52799310714D-01
1.4528884813 0.18558319471
0.61042908544 0.42959071631
0.24216276510 0.43497228231503D+00
D 1 1.00
0.87909318337D-01 1.0000000
F 1 1.00
0.3738600 1.0000000
****
-W 0
S 2 1.00
15.000000000 -0.53315505392
12.000000000 1.0014141748
S 1 1.00
5.2610967725 1.0000000
S 1 1.00
0.92785370307 1.0000000
S 1 1.00
0.40334458241 1.0000000
S 1 1.00
0.11585976646 1.0000000
S 1 1.00
0.41800474073D-01 1.0000000
P 4 1.00
7.2496570000 0.45857265530
6.0848760000 -0.66720686321
1.2523777812 0.52090351989
0.58569208922 0.51885687511
P 1 1.00
0.24106964301 1.0000000
P 1 1.00
0.98600000000D-01 1.0000000
P 1 1.00
0.0403000 1.0000000
D 4 1.00
4.0131231332 -0.63416491808D-01
1.6237452450 0.18452733732
0.69187452392 0.44121676843
0.27865835325 0.43158409241461D+00
D 1 1.00
0.10225296446 1.0000000
F 1 1.00
0.4319900 1.0000000
****
-Re 0
S 2 1.00
14.781862000 -1.1395193885
12.324075000 1.9371421121
S 1 1.00
5.5098597284 1.0000000
S 1 1.00
0.98874104687 1.0000000
S 1 1.00
0.42833312030 1.0000000
S 1 1.00
0.12296804533 1.0000000
S 1 1.00
0.43949851581D-01 1.0000000
P 4 1.00
7.4040050000 0.54510937865
6.3502060000 -0.76096056536
1.3311713455 0.53252276765
0.62659600547 0.51483045040
P 1 1.00
0.25922718696 1.0000000
P 1 1.00
0.11190000000 1.0000000
P 1 1.00
0.04200000000 1.0000000
D 4 1.00
4.0616274916 -0.76667295205D-01
1.8487943286 0.18067495215
0.78702048429 0.45160766937
0.32069843172 0.43261236265745D+00
D 1 1.00
0.11892742980 1.0000000
F 1 1.00
0.4898900 1.0000000
****
-Os 0
S 2 1.00
15.286736000 -1.0647114485
12.700638000 1.8433193269
S 1 1.00
5.7094832504 1.0000000
S 1 1.00
1.0689228744 1.0000000
S 1 1.00
0.46783543749 1.0000000
S 1 1.00
0.13253456992 1.0000000
S 1 1.00
0.47101982911D-01 1.0000000
P 4 1.00
7.9362790000 0.33899369659
6.3036410000 -0.56379438345
1.4351579676 0.52360040577
0.68442749722 0.52445339821
P 1 1.00
0.28347394974 1.0000000
P 1 1.00
0.12830000000 1.0000000
P 1 1.00
0.04800000000 1.0000000
D 4 1.00
3.5808150000 -0.42773932262
3.1961650000 0.44501403992
1.0550226354 0.43689459722
0.41588406618 0.48220605798770D+00
D 1 1.00
0.14653507868 1.0000000
F 1 1.00
0.5506500 1.0000000
****
-Ir 0
S 2 1.00
15.293709000 -1.6731899791
13.573682000 2.3934378976
S 1 1.00
5.8213436542 1.0000000
S 1 1.00
1.1520364268 1.0000000
S 1 1.00
0.51104895338 1.0000000
S 1 1.00
0.14084043578 1.0000000
S 1 1.00
0.49828673085D-01 1.0000000
P 4 1.00
8.6697960000 0.21469187346391
6.2456140000 -0.44863071815131
1.5657036153 0.50653393256771
0.75577412863 0.54052273352337
P 1 1.00
0.31306011113 1.0000000
P 1 1.00
0.13100000000 1.0000000
P 1 1.00
0.0548000 1.0000000
D 4 1.00
3.6994850000 -0.54840155964653
3.3617430000 0.56835425804006
1.1177053710 0.44304381513032
0.44322534858 0.47078394930144
D 1 1.00
0.15641305125 1.0000000
F 1 1.00
0.6100800 1.0000000
****
-Pt 0
S 2 1.00
16.559563000 -0.53808800717
13.892440000 0.91402161377
S 1 1.00
5.8531044732 1.0000000
S 1 1.00
1.2498640609 1.0000000
S 1 1.00
0.55606439459 1.0000000
S 1 1.00
0.13793093812 1.0000000
S 1 1.00
0.48989034059D-01 1.0000000
P 4 1.00
8.1000000000 0.72955608128
7.2000000000 -0.95441807252
1.5588402917 0.57140490320
0.73230402180 0.49508234268
P 1 1.00
0.30270484669 1.0000000
P 1 1.00
0.12300000000 1.0000000
P 1 1.00
0.50000000000D-01 1.0000000
D 4 1.00
4.6299536825 -0.87774450596D-01
2.1980241252 0.21158360681
0.93629991261 0.46533857641
0.37160028160 0.41129165525
D 1 1.00
0.13155928617 1.0000000
F 1 1.00
0.6681300 1.0000000
****
-Au 0
S 2 1.00
20.115299000 -0.15910719389
12.193477000 0.79105526778
S 1 1.00
6.0735294368 1.0000000
S 1 1.00
1.3174451569 1.0000000
S 1 1.00
0.58596768244 1.0000000
S 1 1.00
0.13875427354 1.0000000
S 1 1.00
0.48876985527D-01 1.0000000
P 4 1.00
8.6096650000 0.50053018599
7.3353260000 -0.72681584494
1.6575296365 0.57315511417
0.78159310216 0.49579068859
P 1 1.00
0.32384840661 1.0000000
P 1 1.00
0.13220000000 1.0000000
P 1 1.00
0.0540000 1.0000000
D 4 1.00
4.1439490000 -0.37099566643
3.5682570000 0.40197233762
1.2345757130 0.46001988624
0.48190232338 0.46152130957882D+00
D 1 1.00
0.16490636769 1.0000000
F 1 1.00
0.7248200 1.0000000
****
-Hg 0
S 2 1.00
26.842049000 -0.26845096483D-01
10.320909000 0.81771278143
S 1 1.00
6.3656242291 1.0000000
S 1 1.00
1.3898932095 1.0000000
S 1 1.00
0.63706742699 1.0000000
S 1 1.00
0.16047725098 1.0000000
S 1 1.00
0.56410423453D-01 1.0000000
P 4 1.00
9.7729900000 0.21210940502
7.1690950000 -0.44026342153
1.7559567931 0.58406314464
0.83145670425 0.49359746203
P 1 1.00
0.34494917659 1.0000000
P 1 1.00
0.15540000000 1.0000000
P 1 1.00
0.07000000000 1.0000000
D 4 1.00
4.2800000000 -0.32033414305491
3.4800000000 0.37748470203231
1.2535869926 0.48342275878173
0.50841366863 0.43493523158359
D 1 1.00
0.18501599388 1.0000000
F 1 1.00
0.7956900 1.0000000
****
-Tl 0
S 2 1.00
7.8193195283 -0.18828631537D-01
1.3176904042 0.32093431467
S 6 1.00
45.356924655 0.50938157397D-02
20.278843336 -0.14805704314
14.420612394 0.36768453564
6.2161909754 -0.66820394623
1.5002511178 0.96232806743
0.76330879305 0.33175999361
S 1 1.00
0.17643545481 1.0000000
S 1 1.00
0.65296835238D-01 1.0000000
S 1 1.00
0.24592841139D-01 1.0000000
P 1 1.00
2.0067660913 1.0000000
P 4 1.00
9.0323058024 0.22738839085
7.5356419671 -0.35117975889
1.0521421998 0.25690085604
0.50303932656 0.84549942764D-01
P 1 1.00
0.16675605056 1.0000000
P 1 1.00
0.48596401464D-01 1.0000000
D 5 1.00
9.4421940760 0.58250776986D-01
7.4410003381 -0.11789199301
1.9831617772 0.34232057636
0.91671748567 0.47557282350
0.39647207885 0.30528029435
D 1 1.00
0.15500000000 1.0000000
D 1 1.00
0.39237960293D-01 1.0000000
****
-Pb 0
S 2 1.00
8.0719473648 -0.20412061217D-01
1.4165737490 0.32865829049
S 6 1.00
55.727520333 0.29681153058D-02
20.302912827 -0.14352634362
14.558628750 0.37554188507
6.5370530973 -0.67253099800
1.5933900686 0.95887533909
0.83051419711 0.32593632538
S 1 1.00
0.20418933370 1.0000000
S 1 1.00
0.77159007761D-01 1.0000000
S 1 1.00
0.33059793391D-01 1.0000000
P 1 1.00
2.1359869828 1.0000000
P 4 1.00
9.5531412199 0.20542943990
7.5327685129 -0.36407590058
1.1185539567 0.32217481686
0.53739855255 0.96677743015D-01
P 1 1.00
0.20027494801 1.0000000
P 1 1.00
0.63408011513D-01 1.0000000
D 5 1.00
13.494505735 0.11571042371D-01
7.0609770411 -0.66746645076D-01
2.1581835375 0.33978760942
1.0148541418 0.48523039273
0.44632672920 0.29682924018
D 1 1.00
0.17500000000 1.0000000
D 1 1.00
0.50585085346D-01 1.0000000
****
-Bi 0
S 2 1.00
8.4636832909 -0.20037183144D-01
1.5317838545 0.31054408682
S 6 1.00
175.19632102 0.80278879028D-03
19.820147783 -0.14624461250
14.960110102 0.37435719885
6.7065785571 -0.68476017748
1.7391967524 0.90967322081
0.94504730591 0.38695797807
S 1 1.00
0.23405391503 1.0000000
S 1 1.00
0.90268814613D-01 1.0000000
S 1 1.00
0.41577775054D-01 1.0000000
P 1 1.00
2.8508661858 1.0000000
P 4 1.00
10.672046293 0.14391258793
7.1992185915 -0.37994608603
1.5359697528 0.53268032065
0.72201275727 0.23037698678
P 1 1.00
0.23769418731 1.0000000
P 1 1.00
0.78768140453D-01 1.0000000
D 5 1.00
15.834273510 0.85062993231D-02
7.0956896087 -0.65954380016D-01
2.3363137007 0.33707163406
1.1208861366 0.49128719933
0.50309487376 0.29095930644
D 1 1.00
0.20000000000 1.0000000
D 1 1.00
0.62256480090D-01 1.0000000
****
-Po 0
S 2 1.00
8.7584161749 -0.21561417525D-01
1.6503945866 0.31638990001
S 6 1.00
278.13783916 0.91690497839D-03
19.659291105 -0.14713009283
15.016229647 0.38790413631
7.1149978720 -0.67059966298
1.7879214122 0.91212928327
0.94021655206 0.29153755200
S 1 1.00
0.26329582133 1.0000000
S 1 1.00
0.10190654304 1.0000000
S 1 1.00
0.36854928339D-01 1.0000000
P 1 1.00
2.4460635387 1.0000000
P 4 1.00
10.445945973 0.23631841405
8.0293101888 -0.45017818996
1.3588798023 0.44160334658
0.66829182929 0.14575285544
P 1 1.00
0.27242942777 1.0000000
P 1 1.00
0.88796031338D-01 1.0000000
P 1 1.00
0.24278917089D-01 1.0000000
D 5 1.00
18.292670150 0.72030963652D-02
7.1695578539 -0.66160544754D-01
2.5029225180 0.34363449378
1.2115945443 0.50529101033
0.54713334240 0.28301155453
D 1 1.00
0.21500000000 1.0000000
D 1 1.00
0.60680939679D-01 1.0000000
****
-At 0
S 2 1.00
8.9610112498 -0.23092977605D-01
1.7804284294 0.31690635939
S 6 1.00
303.23376176 0.63504969788D-03
20.289449240 -0.13823165350
15.383783126 0.38333193283
7.4702184232 -0.66837560338
1.8731608346 0.91545877992
0.97426847543 0.25559567998
S 1 1.00
0.29269461143 1.0000000
S 1 1.00
0.11395353119 1.0000000
S 1 1.00
0.42558321816D-01 1.0000000
P 1 1.00
2.4814896839 1.0000000
P 4 1.00
10.722023134 0.26194870008
8.4823338656 -0.46607228264
1.3474291294 0.42119853309
0.62824011467 0.10643224457
P 1 1.00
0.31036518470 1.0000000
P 1 1.00
0.10144862043 1.0000000
P 1 1.00
0.26996558228D-01 1.0000000
D 5 1.00
20.799819604 0.65227965381D-02
7.1664616770 -0.67780885217D-01
2.6934397048 0.33954991335
1.3175112423 0.50899559178
0.59997066293 0.27526771759
D 1 1.00
0.23500000000 1.0000000
D 1 1.00
0.67929272623D-01 1.0000000
****
-Rn 0
S 5 1.00
5187.7442468 0.16097034848D-03
768.14491207 0.10508214789D-02
159.35182065 0.27375438093D-02
21.863432724 -0.55045904905
18.388689978 0.78321373922
S 2 1.00
24.816226448 -0.82636797204D-01
7.2923301677 1.0926256000
S 1 1.00
2.0850437166 1.0000000
S 1 1.00
1.0915245945 1.0000000
S 1 1.00
0.34915708428 1.0000000
S 1 1.00
0.13648422952 1.0000000
S 1 1.00
0.46837581728D-01 1.0000000
P 3 1.00
194.68918723 0.26265814046D-03
11.210013525 0.19952302621
7.5298316489 -0.45994479561
P 4 1.00
9.0845000304 -0.23093917426
6.2631489717 0.39747614192
2.2545193734 0.83026693838
1.1180666918 0.51467013112
P 1 1.00
0.47444492594 1.0000000
P 1 1.00
0.20172354616 1.0000000
P 1 1.00
0.79503144392D-01 1.0000000
P 1 1.00
0.22264519316D-01 1.0000000
D 6 1.00
75.302723665 0.73590238429D-03
17.965913830 0.89490827389D-02
7.3741298033 -0.76641663693D-01
3.2296258578 0.22975404602
1.7937840508 0.43991495311
0.94633319732 0.35259395198
D 1 1.00
0.46860482223 1.0000000
D 1 1.00
0.20000000000 1.0000000
D 1 1.00
0.68815941916D-01 1.0000000
F 1 1.00
2.1000000 1.0000000
F 1 1.00
0.4180600 1.0000000
****
RB 0
RB-ECP 3 28
f potential
1
2 3.8431140 -12.3169000
s-f potential
3
2 5.0365510 89.5001980
2 1.9708490 0.4937610
2 3.8431140 12.3169000
p-f potential
3
2 4.2583410 58.5689740
2 1.4707090 0.4317910
2 3.8431140 12.3169000
d-f potential
3
2 3.0231270 26.2248980
2 0.6503830 0.9628390
2 3.8431140 12.3169000
SR 0
SR-ECP 3 28
f potential
1
2 4.6339750 -15.8059920
s-f potential
3
2 7.4000740 135.4794300
2 3.6063790 17.5344630
2 4.6339750 15.8059920
p-f potential
3
2 6.4848680 88.3597090
2 3.2880530 15.3943720
2 4.6339750 15.8059920
d-f potential
3
2 4.6228410 29.8889870
2 2.2469040 6.6594140
2 4.6339750 15.8059920
Y 0
Y-ECP 3 28
f potential
2
2 6.5842120 -19.12219811
2 3.2921060 -2.43637543
s-f potential
4
2 7.4880494 135.15384412
2 3.7440247 15.55244130
2 6.5842120 19.12219811
2 3.2921060 2.43637543
p-f potential
4
2 6.4453772 87.78499167
2 3.2226886 11.56406599
2 6.5842120 19.12219811
2 3.2921060 2.43637543
d-f potential
4
2 4.6584472 29.70100072
2 2.3292236 5.53996847
2 6.5842120 19.12219811
2 3.2921060 2.43637543
ZR 0
ZR-ECP 3 28
f potential
2
2 7.5400000 -21.09377605
2 3.7700000 -3.08069427
s-f potential
4
2 8.2000000 150.26759106
2 4.0897278 18.97621650
2 7.5400000 21.09377605
2 3.7700000 3.08069427
p-f potential
4
2 7.1100000 99.62212372
2 3.5967980 14.16873329
2 7.5400000 21.09377605
2 3.7700000 3.08069427
d-f potential
4
2 5.3500000 35.04512355
2 2.4918215 6.11125948
2 7.5400000 21.09377605
2 3.7700000 3.08069427
NB 0
NB-ECP 3 28
f potential
2
2 8.4900000 -22.92954996
2 4.2500000 -3.66630986
s-f potential
4
2 8.9000000 165.17914349
2 4.4300000 21.99297437
2 8.4900000 22.92954996
2 4.2500000 3.66630986
p-f potential
4
2 7.7700000 111.79441445
2 3.9600000 16.63348326
2 8.4900000 22.92954996
2 4.2500000 3.66630986
d-f potential
4
2 6.0500000 38.11224880
2 2.8400000 8.03916727
2 8.4900000 22.92954996
2 4.2500000 3.66630986
MO 0
MO-ECP 3 28
f potential
2
2 9.4500000 -24.80517707
2 4.7200000 -4.15378155
s-f potential
4
2 9.7145938 180.10310850
2 4.6805004 24.99722791
2 9.4500000 24.80517707
2 4.7200000 4.15378155
p-f potential
4
2 8.1421366 123.77275231
2 4.6259863 19.53022800
2 9.4500000 24.80517707
2 4.7200000 4.15378155
d-f potential
4
2 6.6184148 48.37502229
2 3.2487516 8.89205274
2 9.4500000 24.80517707
2 4.7200000 4.15378155
TC 0
TC-ECP 3 28
f potential
2
2 10.4000000 -26.56244747
2 5.2000000 -4.58568054
s-f potential
4
2 10.4223462 195.15916591
2 5.0365160 28.09260333
2 10.4000000 26.56244747
2 5.2000000 4.58568054
p-f potential
4
2 8.9504494 135.28456622
2 4.8544394 21.80650430
2 10.4000000 26.56244747
2 5.2000000 4.58568054
d-f potential
4
2 6.9456968 54.32972942
2 3.9705849 11.15506795
2 10.4000000 26.56244747
2 5.2000000 4.58568054
RU 0
RU-ECP 3 28
f potential
2
2 11.3600000 -28.34061627
2 5.6800000 -4.94462923
s-f potential
4
2 11.1052693 209.82297122
2 5.4147454 30.65472642
2 11.3600000 28.34061627
2 5.6800000 4.94462923
p-f potential
4
2 9.7712707 146.33618228
2 5.0739908 24.12787723
2 11.3600000 28.34061627
2 5.6800000 4.94462923
d-f potential
4
2 7.6714231 67.51589667
2 4.1365647 9.87010415
2 11.3600000 28.34061627
2 5.6800000 4.94462923
RH 0
RH-ECP 3 28
f potential
2
2 12.3100000 -30.09345572
2 6.1600000 -5.21848192
s-f potential
4
2 11.7200000 225.34775353
2 5.8200000 32.82318898
2 12.3100000 30.09345572
2 6.1600000 5.21848192
p-f potential
4
2 10.4200000 158.70941159
2 5.4500000 26.44410049
2 12.3100000 30.09345572
2 6.1600000 5.21848192
d-f potential
4
2 8.8200000 62.75862572
2 3.8700000 10.97871947
2 12.3100000 30.09345572
2 6.1600000 5.21848192
PD 0
PD-ECP 3 28
f potential
2
2 13.2700000 -31.92955431
2 6.6300000 -5.39821694
s-f potential
4
2 12.4300000 240.22904033
2 6.1707594 35.17194347
2 13.2700000 31.92955431
2 6.6300000 5.39821694
p-f potential
4
2 11.0800000 170.41727605
2 5.8295541 28.47213287
2 13.2700000 31.92955431
2 6.6300000 5.39821694
d-f potential
4
2 9.5100000 69.01384488
2 4.1397811 11.75086158
2 13.2700000 31.92955431
2 6.6300000 5.39821694
AG 0
AG-ECP 3 28
f potential
2
2 14.2200000 -33.68992012
2 7.1100000 -5.53112021
s-f potential
4
2 13.1300000 255.13936452
2 6.5100000 36.86612154
2 14.2200000 33.68992012
2 7.1100000 5.53112021
p-f potential
4
2 11.7400000 182.18186871
2 6.2000000 30.35775148
2 14.2200000 33.68992012
2 7.1100000 5.53112021
d-f potential
4
2 10.2100000 73.71926087
2 4.3800000 12.50211712
2 14.2200000 33.68992012
2 7.1100000 5.53112021
CD 0
CD-ECP 3 28
f potential
2
2 15.1847957 -35.47662555
2 7.5923978 -5.61767685
s-f potential
4
2 13.8358689 270.00948324
2 6.8572704 38.76730798
2 15.1847957 35.47662555
2 7.5923978 5.61767685
p-f potential
4
2 12.4049710 193.82962939
2 6.5677995 31.89652523
2 15.1847957 35.47662555
2 7.5923978 5.61767685
d-f potential
4
2 10.8969253 79.19364700
2 4.6411649 13.23082674
2 15.1847957 35.47662555
2 7.5923978 5.61767685
IN 0
IN-ECP 3 28
f potential
2
2 12.53905600 -13.72807800
2 12.55256100 -18.20686600
s-f potential
4
2 15.39282200 281.12235000
2 8.05586400 61.90147000
2 12.53905600 13.72807800
2 12.55256100 18.20686600
p-f potential
6
2 13.92867200 67.46215400
2 13.34723400 134.94925000
2 7.61413200 14.74614000
2 7.31836500 29.63926200
2 12.53905600 13.72807800
2 12.55256100 18.20686600
d-f potential
6
2 14.03471500 35.49325400
2 14.51161600 53.17877300
2 5.55055000 9.17728100
2 5.05941500 12.39241000
2 12.53905600 13.72807800
2 12.55256100 18.20686600
SN 0
SN-ECP 3 28
f potential
2
2 12.28234800 -12.57633300
2 12.27215000 -16.59594400
s-f potential
4
2 17.42041400 279.98868200
2 7.63115500 62.37781000
2 12.28234800 12.57633300
2 12.27215000 16.59594400
p-f potential
6
2 16.13102400 66.16252300
2 15.62807700 132.17439600
2 7.32560800 16.33941700
2 6.94251900 32.48895900
2 12.28234800 12.57633300
2 12.27215000 16.59594400
d-f potential
6
2 15.51497600 36.38744100
2 15.18816000 54.50784100
2 5.45602400 8.69682300
2 5.36310500 12.84020800
2 12.28234800 12.57633300
2 12.27215000 16.59594400
SB 0
SB-ECP 3 28
f potential
2
2 14.44497800 -15.36680100
2 14.44929500 -20.29613800
s-f potential
4
2 16.33086500 281.07158100
2 8.55654200 61.71660400
2 14.44497800 15.36680100
2 14.44929500 20.29613800
p-f potential
6
2 14.47033700 67.45738000
2 13.81619400 134.93350300
2 8.42492400 14.71634400
2 8.09272800 29.51851200
2 14.44497800 15.36680100
2 14.44929500 20.29613800
d-f potential
6
2 14.88633100 35.44781500
2 15.14631900 53.14346600
2 5.90826700 9.17922300
2 5.59432200 13.24025300
2 14.44497800 15.36680100
2 14.44929500 20.29613800
TE 0
TE-ECP 3 28
f potential
2
2 15.20616800 -15.74545000
2 15.20170200 -20.74244800
s-f potential
4
2 16.81447300 281.04584300
2 8.79352600 61.62065600
2 15.20616800 15.74545000
2 15.20170200 20.74244800
p-f potential
6
2 14.87780100 67.44946400
2 14.26973100 134.90430400
2 8.72443500 14.68954700
2 8.29151500 29.41506300
2 15.20616800 15.74545000
2 15.20170200 20.74244800
d-f potential
6
2 15.20500800 35.43205700
2 15.22584800 53.13568700
2 6.07176900 9.06980200
2 5.80476000 13.12230400
2 15.20616800 15.74545000
2 15.20170200 20.74244800
I 0
I-ECP 3 28
f potential
4
2 19.45860900 -21.84204000
2 19.34926000 -28.46819100
2 4.82376700 -0.24371300
2 4.88431500 -0.32080400
s-f potential
7
2 40.01583500 49.99429300
2 17.42974700 281.02531700
2 9.00548400 61.57332600
2 19.45860900 21.84204000
2 19.34926000 28.46819100
2 4.82376700 0.24371300
2 4.88431500 0.32080400
p-f potential
8
2 15.35546600 67.44284100
2 14.97183300 134.88113700
2 8.96016400 14.67505100
2 8.25909600 29.37566600
2 19.45860900 21.84204000
2 19.34926000 28.46819100
2 4.82376700 0.24371300
2 4.88431500 0.32080400
d-f potential
10
2 15.06890800 35.43952900
2 14.55532200 53.17605700
2 6.71864700 9.06719500
2 6.45639300 13.20693700
2 1.19177900 0.08933500
2 1.29115700 0.05238000
2 19.45860900 21.84204000
2 19.34926000 28.46819100
2 4.82376700 0.24371300
2 4.88431500 0.32080400
XE 0
XE-ECP 3 28
f potential
4
2 20.88155700 -23.08929500
2 20.78344300 -30.07447500
2 5.25338900 -0.28822700
2 5.36118800 -0.38692400
s-f potential
7
2 40.00518400 49.99796200
2 17.81221400 281.01330300
2 9.30415000 61.53825500
2 20.88155700 23.08929500
2 20.78344300 30.07447500
2 5.25338900 0.28822700
2 5.36118800 0.38692400
p-f potential
8
2 15.70177200 67.43914200
2 15.25860800 134.87471100
2 9.29218400 14.66330000
2 8.55900300 29.35473000
2 20.88155700 23.08929500
2 20.78344300 30.07447500
2 5.25338900 0.28822700
2 5.36118800 0.38692400
d-f potential
10
2 15.18560000 35.43690800
2 14.28450000 53.19577200
2 7.12188900 9.04623200
2 6.99196300 13.22368100
2 0.62394600 0.08485300
2 0.64728400 0.04415500
2 20.88155700 23.08929500
2 20.78344300 30.07447500
2 5.25338900 0.28822700
2 5.36118800 0.38692400
CS 0
CS-ECP 3 46
f potential
1
2 3.1232690 -28.8843090
s-f potential
3
2 4.0797500 84.5477300
2 2.4174060 16.6541730
2 3.1232690 28.8843090
p-f potential
3
2 5.5140800 157.0490590
2 2.1603160 26.4233070
2 3.1232690 28.8843090
d-f potential
3
2 1.8074100 13.1727530
2 0.8581820 3.3428330
2 3.1232690 28.8843090
BA 0
BA-ECP 3 46
f potential
1
2 3.5894650 -33.4731740
s-f potential
3
2 9.5269860 427.8458160
2 4.4875100 204.4175300
2 3.5894650 33.4731740
p-f potential
3
2 8.3159300 293.6058640
2 4.2922170 294.1933160
2 3.5894650 33.4731740
d-f potential
3
2 5.9161080 112.5504020
2 2.8748420 181.7826210
2 3.5894650 33.4731740
LA 0
LA-ECP 3 46
f potential
1
2 4.0286000 -36.0100160
s-f potential
3
2 3.3099000 91.9321770
2 1.6550000 -3.7887640
2 4.0286000 36.0100160
p-f potential
3
2 2.8368000 63.7594860
2 1.4184000 -0.6479580
2 4.0286000 36.0100160
d-f potential
3
2 2.0213000 36.1161730
2 1.0107000 0.2191140
2 4.0286000 36.0100160
HF 0
HF-ECP 3 60
f potential
1
2 1.78576984 10.04672251
s-f potential
3
2 14.76995900 1499.28471073
2 7.38497940 40.28210136
2 1.78576984 -10.04672251
p-f potential
3
2 9.84948950 397.73300533
2 4.92474450 19.31640586
2 1.78576984 -10.04672251
d-f potential
3
2 6.09675640 101.32980526
2 3.04837820 5.87343821
2 1.78576984 -10.04672251
TA 0
TA-ECP 3 60
f potential
1
2 2.01788111 12.01796094
s-f potential
3
2 14.54640770 1345.88064703
2 7.27320380 36.76680620
2 2.01788111 -12.01796094
p-f potential
3
2 9.93556529 378.42530145
2 4.96778243 22.29309086
2 2.01788111 -12.01796094
d-f potential
3
2 6.34737691 104.88395571
2 3.17368846 8.75584805
2 2.01788111 -12.01796094
W 0
W-ECP 3 60
f potential
1
2 2.25888846 14.15257947
s-f potential
3
2 14.32285640 1192.39588226
2 7.16142810 32.52293315
2 2.25888846 -14.15257947
p-f potential
3
2 10.02164110 359.03196711
2 5.01082040 24.03038019
2 2.25888846 -14.15257947
d-f potential
3
2 6.59799743 108.30134897
2 3.29899871 10.98252827
2 2.25888846 -14.15257947
RE 0
RE-ECP 3 60
f potential
1
2 2.50865059 16.44985227
s-f potential
3
2 14.09930510 1038.95157226
2 7.04965250 29.56173830
2 2.50865059 -16.44985227
p-f potential
3
2 10.10771690 339.54350965
2 5.05385830 24.91369646
2 2.50865059 -16.44985227
d-f potential
3
2 6.84861794 111.69965275
2 3.42430897 12.62432927
2 2.50865059 -16.44985227
OS 0
OS-ECP 3 60
f potential
1
2 2.76707510 18.90945701
s-f potential
3
2 13.87575390 885.40571914
2 6.93787690 25.96704014
2 2.76707510 -18.90945701
p-f potential
3
2 10.19379260 320.08390185
2 5.09689620 26.14876493
2 2.76707510 -18.90945701
d-f potential
3
2 7.09923846 115.04484313
2 3.54961923 13.62257457
2 2.76707510 -18.90945701
IR 0
IR-ECP 3 60
f potential
1
2 3.03407192 21.53103107
s-f potential
3
2 13.65220260 732.26919978
2 6.82610130 26.48472087
2 3.03407192 -21.53103107
p-f potential
3
2 10.27986840 299.48947357
2 5.13993410 26.46623354
2 3.03407192 -21.53103107
d-f potential
3
2 7.34985897 124.45759451
2 3.67492949 14.03599518
2 3.03407192 -21.53103107
PT 0
PT-ECP 3 60
f potential
1
2 3.30956857 24.31437573
s-f potential
3
2 13.42865130 579.22386092
2 6.71432560 29.66949062
2 3.30956857 -24.31437573
p-f potential
3
2 10.36594420 280.86077422
2 5.18297210 26.74538204
2 3.30956857 -24.31437573
d-f potential
3
2 7.60047949 120.39644429
2 3.80023974 15.81092058
2 3.30956857 -24.31437573
AU 0
AU-ECP 3 60
f potential
2
2 4.78982000 30.49008890
2 2.39491000 5.17107381
s-f potential
4
2 13.20510000 426.84667920
2 6.60255000 37.00708285
2 4.78982000 -30.49008890
2 2.39491000 -5.17107381
p-f potential
4
2 10.45202000 261.19958038
2 5.22601000 26.96249604
2 4.78982000 -30.49008890
2 2.39491000 -5.17107381
d-f potential
4
2 7.85110000 124.79066561
2 3.92555000 16.30072573
2 4.78982000 -30.49008890
2 2.39491000 -5.17107381
HG 0
HG-ECP 3 60
f potential
1
2 3.88579112 30.36499643
s-f potential
3
2 12.98154870 275.73721174
2 6.49077440 49.08921249
2 3.88579112 -30.36499643
p-f potential
3
2 10.53809580 241.54007398
2 5.26904790 27.39659081
2 3.88579112 -30.36499643
d-f potential
3
2 8.10172051 127.86700761
2 4.05086026 16.60831151
2 3.88579112 -30.36499643
TL 0
TL-ECP 3 60
f potential
4
2 5.62639900 15.82548800
2 5.54895200 21.10402100
2 2.87494600 2.91512700
2 2.82145100 3.89690300
s-f potential
6
2 12.16780500 281.28466300
2 8.29490900 62.43425100
2 5.62639900 -15.82548800
2 5.54895200 -21.10402100
2 2.87494600 -2.91512700
2 2.82145100 -3.89690300
p-f potential
8
2 7.15149200 4.63340800
2 5.17286500 9.34175600
2 9.89107200 72.29925300
2 9.00339100 144.55803700
2 5.62639900 -15.82548800
2 5.54895200 -21.10402100
2 2.87494600 -2.91512700
2 2.82145100 -3.89690300
d-f potential
8
2 7.13021800 35.94303900
2 6.92690600 53.90959300
2 5.41757000 10.38193900
2 5.13868100 15.58382200
2 5.62639900 -15.82548800
2 5.54895200 -21.10402100
2 2.87494600 -2.91512700
2 2.82145100 -3.89690300
PB 0
PB-ECP 3 60
f potential
2
2 3.88751200 12.20989200
2 3.81196300 16.19029100
s-f potential
4
2 12.29630300 281.28549900
2 8.63263400 62.52021700
2 3.88751200 -12.20989200
2 3.81196300 -16.19029100
p-f potential
6
2 10.24179000 72.27689700
2 8.92417600 144.59108300
2 6.58134200 4.75869300
2 6.25540300 9.94062100
2 3.88751200 -12.20989200
2 3.81196300 -16.19029100
d-f potential
6
2 7.75433600 35.84850700
2 7.72028100 53.72434200
2 4.97026400 10.11525600
2 4.56378900 14.83373100
2 3.88751200 -12.20989200
2 3.81196300 -16.19029100
BI 0
BI-ECP 3 60
f potential
2
2 4.21454600 13.71338300
2 4.13340000 18.19430800
s-f potential
4
2 13.04309000 283.26422700
2 8.22168200 62.47195900
2 4.21454600 -13.71338300
2 4.13340000 -18.19430800
p-f potential
6
2 10.46777700 72.00149900
2 9.11890100 144.00227700
2 6.75479100 5.00794500
2 6.25259200 9.99155000
2 4.21454600 -13.71338300
2 4.13340000 -18.19430800
d-f potential
6
2 8.08147400 36.39625900
2 7.89059500 54.59766400
2 4.95555600 9.98429400
2 4.70455900 14.98148500
2 4.21454600 -13.71338300
2 4.13340000 -18.19430800
PO 0
PO-ECP 3 60
f potential
4
2 5.01327000 17.42829500
2 4.98464000 23.38035300
2 1.32676000 0.16339200
2 1.52875800 0.32456600
s-f potential
6
2 13.27722700 283.24470600
2 8.39951800 62.39646100
2 5.01327000 -17.42829500
2 4.98464000 -23.38035300
2 1.32676000 -0.16339200
2 1.52875800 -0.32456600
p-f potential
8
2 10.66568200 71.99171600
2 9.28375300 143.97187100
2 6.87274900 4.94961500
2 6.32615000 9.74049900
2 5.01327000 -17.42829500
2 4.98464000 -23.38035300
2 1.32676000 -0.16339200
2 1.52875800 -0.32456600
d-f potential
8
2 8.21486600 36.37838300
2 8.00869600 54.56271500
2 5.05522700 9.88949900
2 4.78255300 14.69387700
2 5.01327000 -17.42829500
2 4.98464000 -23.38035300
2 1.32676000 -0.16339200
2 1.52875800 -0.32456600
AT 0
AT-ECP 3 60
f potential
4
2 5.81216300 19.87019800
2 5.75371500 26.41645200
2 2.51347200 0.99497000
2 2.53626100 1.49070100
s-f potential
7
2 30.20083200 49.95715800
2 13.61230600 283.21037100
2 8.52934000 62.28105200
2 5.81216300 -19.87019800
2 5.75371500 -26.41645200
2 2.51347200 -0.99497000
2 2.53626100 -1.49070100
p-f potential
8
2 10.85406500 71.98237100
2 9.46822900 143.90353200
2 7.03111400 4.87175900
2 6.14385800 8.98305900
2 5.81216300 -19.87019800
2 5.75371500 -26.41645200
2 2.51347200 -0.99497000
2 2.53626100 -1.49070100
d-f potential
8
2 8.31351500 36.36323700
2 7.99896500 54.54897000
2 5.17996600 9.77628500
2 4.94222600 14.26475500
2 5.81216300 -19.87019800
2 5.75371500 -26.41645200
2 2.51347200 -0.99497000
2 2.53626100 -1.49070100
RN 0
RN-ECP 3 60
f potential
4
2 6.34857100 21.79729000
2 6.29594900 28.94680500
2 2.88211800 1.44736500
2 2.90804800 2.17796400
s-f potential
7
2 30.15124200 49.96555100
2 14.52124100 283.07000000
2 8.05203800 62.00287000
2 6.34857100 -21.79729000
2 6.29594900 -28.94680500
2 2.88211800 -1.44736500
2 2.90804800 -2.17796400
p-f potential
8
2 11.00994200 71.96911900
2 9.61762500 143.86055900
2 7.33600800 4.71476100
2 6.40625300 9.01306500
2 6.34857100 -21.79729000
2 6.29594900 -28.94680500
2 2.88211800 -1.44736500
2 2.90804800 -2.17796400
d-f potential
8
2 8.36922000 36.36836500
2 8.11697500 54.55176100
2 5.35365600 9.63448700
2 5.09721200 14.38790200
2 6.34857100 -21.79729000
2 6.29594900 -28.94680500
2 2.88211800 -1.44736500
2 2.90804800 -2.17796400