# all_value

name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Os
data:
OSMIUM
S   28
  1 91549282.0000000            2.41807711D-06   
  2 18522020.0000000            1.36590433D-05   
  3 4348043.2000000             7.77789735D-05   
  4 1171256.9000000             3.60458206D-04   
  5 357424.6400000              1.43681584D-03   
  6 121823.6200000              4.97171565D-03   
  7  45688.2330000              1.51828868D-02   
  8  18572.7720000              4.11449420D-02   
  9   8066.3284000              9.80920806D-02   
 10   3693.4349000              1.98008609D-01   
 11   1762.1595000              3.10081776D-01   
 12    867.3457500              3.13349253D-01   
 13    436.8421500              1.46644326D-01   
 14    223.6815800              1.69120113D-02   
 15    115.8641500              1.12212483D-03   
 16     60.4882450             -6.78088653D-04   
 17     31.7417860              4.60224476D-04   
 18     16.7114330             -3.89622073D-04   
 19      8.8158517              2.92434778D-04   
 20      4.6560883             -2.07850637D-04   
 21      2.4606951              1.51687557D-04   
 22      1.3008853             -1.08345460D-04   
 23      0.68784262             7.52550497D-05   
 24      0.36372127            -5.06497693D-05   
 25      0.19233546             3.17956994D-05   
 26      0.10170760            -1.75268915D-05   
 27      0.53783400E-01         7.44764254D-06   
 28      0.28440892E-01        -1.77076805D-06   
S   28
  1 91549282.0000000            8.03599946D-07   
  2 18522020.0000000            4.53848599D-06   
  3 4348043.2000000             2.58534808D-05   
  4 1171256.9000000             1.19831413D-04   
  5 357424.6400000              4.78460479D-04   
  6 121823.6200000              1.66106124D-03   
  7  45688.2330000              5.12304916D-03   
  8  18572.7720000              1.41796977D-02   
  9   8066.3284000              3.54683435D-02   
 10   3693.4349000              7.87506789D-02   
 11   1762.1595000              1.48782577D-01   
 12    867.3457500              2.05676956D-01   
 13    436.8421500              1.11249951D-01   
 14    223.6815800             -2.80682313D-01   
 15    115.8641500             -5.88687209D-01   
 16     60.4882450             -3.04877143D-01   
 17     31.7417860             -2.74388446D-02   
 18     16.7114330             -2.57798416D-03   
 19      8.8158517              1.76386698D-03   
 20      4.6560883             -1.02690130D-03   
 21      2.4606951              7.90543360D-04   
 22      1.3008853             -5.69418831D-04   
 23      0.68784262             3.88447777D-04   
 24      0.36372127            -2.63852723D-04   
 25      0.19233546             1.65701818D-04   
 26      0.10170760            -9.15531662D-05   
 27      0.53783400E-01         3.89743308D-05   
 28      0.28440892E-01        -9.27961544D-06   
S   28
  1 91549282.0000000            3.79283533D-07   
  2 18522020.0000000            2.14191748D-06   
  3 4348043.2000000             1.22028473D-05   
  4 1171256.9000000             5.65579570D-05   
  5 357424.6400000              2.25898456D-04   
  6 121823.6200000              7.84570831D-04   
  7  45688.2330000              2.42371151D-03   
  8  18572.7720000              6.72919524D-03   
  9   8066.3284000              1.69604351D-02   
 10   3693.4349000              3.82137222D-02   
 11   1762.1595000              7.44645488D-02   
 12    867.3457500              1.08828587D-01   
 13    436.8421500              6.48105489D-02   
 14    223.6815800             -2.07140942D-01   
 15    115.8641500             -6.05270055D-01   
 16     60.4882450             -3.58992484D-01   
 17     31.7417860              6.94310889D-01   
 18     16.7114330              6.77273117D-01   
 19      8.8158517              9.17454507D-02   
 20      4.6560883              1.65073206D-02   
 21      2.4606951             -8.62029641D-03   
 22      1.3008853              6.43962291D-03   
 23      0.68784262            -4.76067901D-03   
 24      0.36372127             3.21142612D-03   
 25      0.19233546            -2.04918373D-03   
 26      0.10170760             1.13872291D-03   
 27      0.53783400E-01        -4.86691220D-04   
 28      0.28440892E-01         1.16153580D-04   
S   28
  1 91549282.0000000            1.86393249D-07   
  2 18522020.0000000            1.05185978D-06   
  3 4348043.2000000             5.99795312D-06   
  4 1171256.9000000             2.77722305D-05   
  5 357424.6400000              1.11059548D-04   
  6 121823.6200000              3.85234083D-04   
  7  45688.2330000              1.19255255D-03   
  8  18572.7720000              3.30635586D-03   
  9   8066.3284000              8.37155411D-03   
 10   3693.4349000              1.88601949D-02   
 11   1762.1595000              3.72119131D-02   
 12    867.3457500              5.46770699D-02   
 13    436.8421500              3.43478071D-02   
 14    223.6815800             -1.15141578D-01   
 15    115.8641500             -3.55838204D-01   
 16     60.4882450             -2.52753626D-01   
 17     31.7417860              6.90969150D-01   
 18     16.7114330              9.21833864D-01   
 19      8.8158517             -3.97870473D-01   
 20      4.6560883             -9.18425176D-01   
 21      2.4606951             -2.68662370D-01   
 22      1.3008853             -5.67775282D-03   
 23      0.68784262            -6.10398222D-03   
 24      0.36372127             2.61840191D-03   
 25      0.19233546            -1.77206544D-03   
 26      0.10170760             9.53162651D-04   
 27      0.53783400E-01        -4.05936450D-04   
 28      0.28440892E-01         9.67804466D-05   
S   28
  1 91549282.0000000           -7.61995790D-08   
  2 18522020.0000000           -4.29770935D-07   
  3 4348043.2000000            -2.45235431D-06   
  4 1171256.9000000            -1.13463297D-05   
  5 357424.6400000             -4.54149933D-05   
  6 121823.6200000             -1.57364231D-04   
  7  45688.2330000             -4.87845777D-04   
  8  18572.7720000             -1.35047801D-03   
  9   8066.3284000             -3.42825307D-03   
 10   3693.4349000             -7.70760162D-03   
 11   1762.1595000             -1.52934765D-02   
 12    867.3457500             -2.23978401D-02   
 13    436.8421500             -1.44438958D-02   
 14    223.6815800              4.87794315D-02   
 15    115.8641500              1.50740225D-01   
 16     60.4882450              1.14926302D-01   
 17     31.7417860             -3.38311859D-01   
 18     16.7114330             -4.64364106D-01   
 19      8.8158517              2.37449994D-01   
 20      4.6560883              8.65008570D-01   
 21      2.4606951              3.49144792D-01   
 22      1.3008853             -6.59027790D-01   
 23      0.68784262            -6.60966153D-01   
 24      0.36372127            -1.92195332D-01   
 25      0.19233546            -2.12953742D-03   
 26      0.10170760            -5.37142627D-03   
 27      0.53783400E-01         2.17201815D-03   
 28      0.28440892E-01        -5.29516587D-04   
S   28
  1 91549282.0000000            1.99455098D-08   
  2 18522020.0000000            1.12474608D-07   
  3 4348043.2000000             6.41938660D-07   
  4 1171256.9000000             2.96935321D-06   
  5 357424.6400000              1.18885283D-05   
  6 121823.6200000              4.11803567D-05   
  7  45688.2330000              1.27718551D-04   
  8  18572.7720000              3.53379029D-04   
  9   8066.3284000              8.97734481D-04   
 10   3693.4349000              2.01680298D-03   
 11   1762.1595000              4.00768422D-03   
 12    867.3457500              5.86067100D-03   
 13    436.8421500              3.80599185D-03   
 14    223.6815800             -1.28588745D-02   
 15    115.8641500             -3.96280327D-02   
 16     60.4882450             -3.06740497D-02   
 17     31.7417860              9.12550306D-02   
 18     16.7114330              1.25095068D-01   
 19      8.8158517             -6.41073081D-02   
 20      4.6560883             -2.64074454D-01   
 21      2.4606951             -1.04852504D-01   
 22      1.3008853              2.46483008D-01   
 23      0.68784262             3.43152159D-01   
 24      0.36372127             1.89611151D-01   
 25      0.19233546            -8.83205566D-02   
 26      0.10170760            -4.32770890D-01   
 27      0.53783400E-01        -4.57754825D-01   
 28      0.28440892E-01        -2.55927194D-01   
P   21
  1 357424.6400000              8.89386577D-06   
  2 121823.6200000              4.16946867D-05   
  3  45688.2330000              2.22200002D-04   
  4  18572.7720000              9.66869874D-04   
  5   8066.3284000              3.77466630D-03   
  6   3693.4349000              1.31327677D-02   
  7   1762.1595000              4.06037006D-02   
  8    867.3457500              1.08583525D-01   
  9    436.8421500              2.33397810D-01   
 10    223.6815800              3.57149534D-01   
 11    115.8641500              3.05252182D-01   
 12     60.4882450              1.03477184D-01   
 13     31.7417860              7.68239236D-03   
 14     16.7114330              4.00350515D-04   
 15      8.8158517             -2.94340873D-04   
 16      4.6560883              8.29741447D-05   
 17      2.4606951             -7.33415647D-05   
 18      1.3008853              4.62825415D-05   
 19      0.68784262            -2.36958259D-05   
 20      0.36372127             1.13928199D-05   
 21      0.19233546            -2.86067985D-06   
P   21
  1 357424.6400000             -4.45642964D-06   
  2 121823.6200000             -2.07811220D-05   
  3  45688.2330000             -1.11476790D-04   
  4  18572.7720000             -4.83975965D-04   
  5   8066.3284000             -1.90599978D-03   
  6   3693.4349000             -6.67687125D-03   
  7   1762.1595000             -2.11209307D-02   
  8    867.3457500             -5.84511103D-02   
  9    436.8421500             -1.33438101D-01   
 10    223.6815800             -2.18132120D-01   
 11    115.8641500             -1.52930421D-01   
 12     60.4882450              2.32846413D-01   
 13     31.7417860              5.70856226D-01   
 14     16.7114330              3.12947761D-01   
 15      8.8158517              4.17183058D-02   
 16      4.6560883              3.82248301D-03   
 17      2.4606951             -9.56944147D-04   
 18      1.3008853              6.87077723D-04   
 19      0.68784262            -4.40606037D-04   
 20      0.36372127             1.88906993D-04   
 21      0.19233546            -5.22565757D-05   
P   21
  1 357424.6400000              2.16273893D-06   
  2 121823.6200000              1.01146392D-05   
  3  45688.2330000              5.41203586D-05   
  4  18572.7720000              2.35613111D-04   
  5   8066.3284000              9.27200028D-04   
  6   3693.4349000              3.26089922D-03   
  7   1762.1595000              1.03488928D-02   
  8    867.3457500              2.89269099D-02   
  9    436.8421500              6.68877109D-02   
 10    223.6815800              1.11643472D-01   
 11    115.8641500              7.19985410D-02   
 12     60.4882450             -1.78872701D-01   
 13     31.7417860             -4.69325895D-01   
 14     16.7114330             -1.27352853D-01   
 15      8.8158517              5.26105044D-01   
 16      4.6560883              5.45239441D-01   
 17      2.4606951              1.45192029D-01   
 18      1.3008853              9.95023598D-03   
 19      0.68784262             6.71012938D-04   
 20      0.36372127             2.09693578D-04   
 21      0.19233546            -6.22476105D-05   
P   21
  1 357424.6400000              8.17445412D-07   
  2 121823.6200000              3.82939492D-06   
  3  45688.2330000              2.04577375D-05   
  4  18572.7720000              8.91893746D-05   
  5   8066.3284000              3.50681770D-04   
  6   3693.4349000              1.23508800D-03   
  7   1762.1595000              3.92039242D-03   
  8    867.3457500              1.09863324D-02   
  9    436.8421500              2.54622067D-02   
 10    223.6815800              4.27112585D-02   
 11    115.8641500              2.69836233D-02   
 12     60.4882450             -7.39996586D-02   
 13     31.7417860             -1.98670248D-01   
 14     16.7114330             -3.49644959D-02   
 15      8.8158517              2.96558311D-01   
 16      4.6560883              3.72854386D-01   
 17      2.4606951             -6.23781675D-02   
 18      1.3008853             -4.92217233D-01   
 19      0.68784262            -4.58615372D-01   
 20      0.36372127            -1.63165385D-01   
 21      0.19233546            -2.94063153D-02   
D   18
  1   8066.3284000              9.68727720D-05   
  2   3693.4349000              3.56320625D-04   
  3   1762.1595000              1.84225276D-03   
  4    867.3457500              7.75379476D-03   
  5    436.8421500              2.86990149D-02   
  6    223.6815800              8.92342139D-02   
  7    115.8641500              2.13718166D-01   
  8     60.4882450              3.57113771D-01   
  9     31.7417860              3.45473311D-01   
 10     16.7114330              1.44923253D-01   
 11      8.8158517              2.18205520D-02   
 12      4.6560883              1.25638929D-03   
 13      2.4606951              3.08068626D-04   
 14      1.3008853             -5.68534328D-05   
 15      0.68784262             4.84785727D-05   
 16      0.36372127            -3.28579367D-05   
 17      0.19233546             1.32301598D-05   
 18      0.10170760            -4.67338651D-06   
D   18
  1   8066.3284000             -4.81035925D-05   
  2   3693.4349000             -1.80877947D-04   
  3   1762.1595000             -9.20516396D-04   
  4    867.3457500             -3.94632472D-03   
  5    436.8421500             -1.46215929D-02   
  6    223.6815800             -4.65622757D-02   
  7    115.8641500             -1.12955706D-01   
  8     60.4882450             -1.85957099D-01   
  9     31.7417860             -1.25736609D-01   
 10     16.7114330              1.80983011D-01   
 11      8.8158517              4.42616454D-01   
 12      4.6560883              3.81734028D-01   
 13      2.4606951              1.35656215D-01   
 14      1.3008853              1.90083747D-02   
 15      0.68784262             9.42156719D-04   
 16      0.36372127             3.48475998D-04   
 17      0.19233546            -9.18172859D-05   
 18      0.10170760             4.15643116D-05   
D   18
  1   8066.3284000              1.35504029D-05   
  2   3693.4349000              5.15810405D-05   
  3   1762.1595000              2.59744477D-04   
  4    867.3457500              1.12276673D-03   
  5    436.8421500              4.14607575D-03   
  6    223.6815800              1.32907521D-02   
  7    115.8641500              3.22336300D-02   
  8     60.4882450              5.31133790D-02   
  9     31.7417860              3.21918874D-02   
 10     16.7114330             -6.82924457D-02   
 11      8.8158517             -1.53026028D-01   
 12      4.6560883             -1.21331604D-01   
 13      2.4606951              7.23803332D-02   
 14      1.3008853              2.85321662D-01   
 15      0.68784262             3.57329455D-01   
 16      0.36372127             2.98908473D-01   
 17      0.19233546             1.51157629D-01   
 18      0.10170760             5.98203814D-02   
F   12
  1    867.3457500              1.86860265D-04   
  2    436.8421500              7.66413781D-04   
  3    223.6815800              3.91660910D-03   
  4    115.8641500              1.65025948D-02   
  5     60.4882450              5.38240314D-02   
  6     31.7417860              1.37958461D-01   
  7     16.7114330              2.51870669D-01   
  8      8.8158517              3.17674254D-01   
  9      4.6560883              2.89995962D-01   
 10      2.4606951              1.84347158D-01   
 11      1.3008853              7.36386624D-02   
 12      0.68784262             2.18615428D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Ir
data:
IRIDIUM
S   28
  1 94689771.0000000            2.38854663D-06   
  2 19312937.0000000            1.33285288D-05   
  3 4555994.7000000             7.56320660D-05   
  4 1230017.6000000             3.50050183D-04   
  5 375413.9800000              1.39726016D-03   
  6 127789.3000000              4.84910400D-03   
  7  47823.6340000              1.48643126D-02   
  8  19394.0760000              4.04430011D-02   
  9   8404.2078000              9.67964745D-02   
 10   3841.4461000              1.96180052D-01   
 11   1830.8483000              3.08766385D-01   
 12    900.9006100              3.14729209D-01   
 13    453.9605200              1.49811062D-01   
 14    232.7207100              1.79592341D-02   
 15    120.7602100              1.13559433D-03   
 16     63.1866630             -6.73053131D-04   
 17     33.2450730              4.63469820D-04   
 18     17.5537630             -3.96199540D-04   
 19      9.2889135              2.98477071D-04   
 20      4.9217725             -2.12965068D-04   
 21      2.6097127              1.55952778D-04   
 22      1.3842960             -1.11659374D-04   
 23      0.73442114             7.76947900D-05   
 24      0.38966943            -5.23593823D-05   
 25      0.20675729             3.28879427D-05   
 26      0.10970579            -1.81220340D-05   
 27      0.58210227E-01         7.68822196D-06   
 28      0.30886535E-01        -1.82286287D-06   
S   28
  1 94689771.0000000            7.94334575D-07   
  2 19312937.0000000            4.43175193D-06   
  3 4555994.7000000             2.51571083D-05   
  4 1230017.6000000             1.16451247D-04   
  5 375413.9800000              4.65587877D-04   
  6 127789.3000000              1.62104645D-03   
  7  47823.6340000              5.01755332D-03   
  8  19394.0760000              1.39393547D-02   
  9   8404.2078000              3.49823136D-02   
 10   3841.4461000              7.79102857D-02   
 11   1830.8483000              1.47668998D-01   
 12    900.9006100              2.05513844D-01   
 13    453.9605200              1.15229074D-01   
 14    232.7207100             -2.71053713D-01   
 15    120.7602100             -5.87042885D-01   
 16     63.1866630             -3.14058278D-01   
 17     33.2450730             -3.01465512D-02   
 18     17.5537630             -2.63369082D-03   
 19      9.2889135              1.79429033D-03   
 20      4.9217725             -1.05963227D-03   
 21      2.6097127              8.23144531D-04   
 22      1.3842960             -5.95463022D-04   
 23      0.73442114             4.07159217D-04   
 24      0.38966943            -2.76870714D-04   
 25      0.20675729             1.73861538D-04   
 26      0.10970579            -9.59444360D-05   
 27      0.58210227E-01         4.07446951D-05   
 28      0.30886535E-01        -9.66749944D-06   
S   28
  1 94689771.0000000            3.75484964D-07   
  2 19312937.0000000            2.09467947D-06   
  3 4555994.7000000             1.18924429D-05   
  4 1230017.6000000             5.50446263D-05   
  5 375413.9800000              2.20159631D-04   
  6 127789.3000000              7.66794872D-04   
  7  47823.6340000              2.37741628D-03   
  8  19394.0760000              6.62429793D-03   
  9   8404.2078000              1.67519908D-02   
 10   3841.4461000              3.78490789D-02   
 11   1830.8483000              7.39896452D-02   
 12    900.9006100              1.08781425D-01   
 13    453.9605200              6.72042742D-02   
 14    232.7207100             -1.99777585D-01   
 15    120.7602100             -5.99964821D-01   
 16     63.1866630             -3.77909266D-01   
 17     33.2450730              6.72657604D-01   
 18     17.5537630              6.93828465D-01   
 19      9.2889135              1.01155060D-01   
 20      4.9217725              1.69284936D-02   
 21      2.6097127             -8.68016121D-03   
 22      1.3842960              6.52667553D-03   
 23      0.73442114            -4.85336619D-03   
 24      0.38966943             3.27908245D-03   
 25      0.20675729            -2.09442649D-03   
 26      0.10970579             1.16308069D-03   
 27      0.58210227E-01        -4.96101383D-04   
 28      0.30886535E-01         1.18017288D-04   
S   28
  1 94689771.0000000            1.85193661D-07   
  2 19312937.0000000            1.03240113D-06   
  3 4555994.7000000             5.86648674D-06   
  4 1230017.6000000             2.71275533D-05   
  5 375413.9800000              1.08627678D-04   
  6 127789.3000000              3.77881589D-04   
  7  47823.6340000              1.17395243D-03   
  8  19394.0760000              3.26675809D-03   
  9   8404.2078000              8.29778591D-03   
 10   3841.4461000              1.87489745D-02   
 11   1830.8483000              3.71006912D-02   
 12    900.9006100              5.48582021D-02   
 13    453.9605200              3.56755864D-02   
 14    232.7207100             -1.11376261D-01   
 15    120.7602100             -3.53727123D-01   
 16     63.1866630             -2.65735640D-01   
 17     33.2450730              6.67796371D-01   
 18     17.5537630              9.45149102D-01   
 19      9.2889135             -3.58285067D-01   
 20      4.9217725             -9.33248563D-01   
 21      2.6097127             -2.84830466D-01   
 22      1.3842960             -6.59767885D-03   
 23      0.73442114            -6.57218413D-03   
 24      0.38966943             2.82621569D-03   
 25      0.20675729            -1.91803730D-03   
 26      0.10970579             1.02957195D-03   
 27      0.58210227E-01        -4.37573628D-04   
 28      0.30886535E-01         1.03971995D-04   
S   28
  1 94689771.0000000           -7.67017354D-08   
  2 19312937.0000000           -4.27339631D-07   
  3 4555994.7000000            -2.43006200D-06   
  4 1230017.6000000            -1.12279521D-05   
  5 375413.9800000             -4.50032016D-05   
  6 127789.3000000             -1.56380151D-04   
  7  47823.6340000             -4.86537243D-04   
  8  19394.0760000             -1.35175344D-03   
  9   8404.2078000             -3.44266288D-03   
 10   3841.4461000             -7.76226181D-03   
 11   1830.8483000             -1.54487127D-02   
 12    900.9006100             -2.27649923D-02   
 13    453.9605200             -1.51982973D-02   
 14    232.7207100              4.78460395D-02   
 15    120.7602100              1.51782929D-01   
 16     63.1866630              1.22383196D-01   
 17     33.2450730             -3.31765860D-01   
 18     17.5537630             -4.82936222D-01   
 19      9.2889135              2.14404878D-01   
 20      4.9217725              8.88994851D-01   
 21      2.6097127              3.73238157D-01   
 22      1.3842960             -6.64841006D-01   
 23      0.73442114            -6.64565179D-01   
 24      0.38966943            -1.98015058D-01   
 25      0.20675729            -2.14475260D-03   
 26      0.10970579            -5.91326467D-03   
 27      0.58210227E-01         2.39322076D-03   
 28      0.30886535E-01        -5.83021251D-04   
S   28
  1 94689771.0000000            2.00317539D-08   
  2 19312937.0000000            1.11583462D-07   
  3 4555994.7000000             6.34675359D-07   
  4 1230017.6000000             2.93166901D-06   
  5 375413.9800000              1.17543417D-05   
  6 127789.3000000              4.08291874D-05   
  7  47823.6340000              1.27091925D-04   
  8  19394.0760000              3.52898863D-04   
  9   8404.2078000              8.99517254D-04   
 10   3841.4461000              2.02638525D-03   
 11   1830.8483000              4.03966403D-03   
 12    900.9006100              5.94243096D-03   
 13    453.9605200              3.99790269D-03   
 14    232.7207100             -1.25935081D-02   
 15    120.7602100             -3.98050393D-02   
 16     63.1866630             -3.26226536D-02   
 17     33.2450730              8.94304249D-02   
 18     17.5537630              1.29843589D-01   
 19      9.2889135             -5.72924320D-02   
 20      4.9217725             -2.72062909D-01   
 21      2.6097127             -1.11200175D-01   
 22      1.3842960              2.49500047D-01   
 23      0.73442114             3.43450721D-01   
 24      0.38966943             1.83591828D-01   
 25      0.20675729            -7.21756136D-02   
 26      0.10970579            -4.27349474D-01   
 27      0.58210227E-01        -4.39607822D-01   
 28      0.30886535E-01        -2.89055165D-01   
P   21
  1 375413.9800000              8.55599040D-06   
  2 127789.3000000              4.02877890D-05   
  3  47823.6340000              2.15554429D-04   
  4  19394.0760000              9.42581987D-04   
  5   8404.2078000              3.69461659D-03   
  6   3841.4461000              1.28957026D-02   
  7   1830.8483000              3.99579858D-02   
  8    900.9006100              1.07058292D-01   
  9    453.9605200              2.30742853D-01   
 10    232.7207100              3.55189544D-01   
 11    120.7602100              3.07776510D-01   
 12     63.1866630              1.07212031D-01   
 13     33.2450730              8.38456724D-03   
 14     17.5537630              4.33248071D-04   
 15      9.2889135             -3.14346303D-04   
 16      4.9217725              9.66135170D-05   
 17      2.6097127             -8.38709266D-05   
 18      1.3842960              5.38601587D-05   
 19      0.73442114            -2.76341577D-05   
 20      0.38966943             1.33265463D-05   
 21      0.20675729            -3.32738587D-06   
P   21
  1 375413.9800000             -4.29411714D-06   
  2 127789.3000000             -2.01252173D-05   
  3  47823.6340000             -1.08315858D-04   
  4  19394.0760000             -4.72811985D-04   
  5   8404.2078000             -1.86856973D-03   
  6   3841.4461000             -6.56887870D-03   
  7   1830.8483000             -2.08146094D-02   
  8    900.9006100             -5.77166319D-02   
  9    453.9605200             -1.32046184D-01   
 10    232.7207100             -2.17301190D-01   
 11    120.7602100             -1.57064854D-01   
 12     63.1866630              2.21772598D-01   
 13     33.2450730              5.68189685D-01   
 14     17.5537630              3.22747248D-01   
 15      9.2889135              4.52111491D-02   
 16      4.9217725              4.06329373D-03   
 17      2.6097127             -1.02756574D-03   
 18      1.3842960              7.31190773D-04   
 19      0.73442114            -4.76710843D-04   
 20      0.38966943             2.02969385D-04   
 21      0.20675729            -5.64807061D-05   
P   21
  1 375413.9800000              2.09302890D-06   
  2 127789.3000000              9.83985180D-06   
  3  47823.6340000              5.28150207D-05   
  4  19394.0760000              2.31211838D-04   
  5   8404.2078000              9.12968447D-04   
  6   3841.4461000              3.22246877D-03   
  7   1830.8483000              1.02432557D-02   
  8    900.9006100              2.86899838D-02   
  9    453.9605200              6.64757479D-02   
 10    232.7207100              1.11730061D-01   
 11    120.7602100              7.48171461D-02   
 12     63.1866630             -1.72151963D-01   
 13     33.2450730             -4.68986558D-01   
 14     17.5537630             -1.45411086D-01   
 15      9.2889135              5.15329307D-01   
 16      4.9217725              5.55826306D-01   
 17      2.6097127              1.51880178D-01   
 18      1.3842960              1.06584282D-02   
 19      0.73442114             7.60470154D-04   
 20      0.38966943             2.22257625D-04   
 21      0.20675729            -5.53052319D-05   
P   21
  1 375413.9800000              8.04137443D-07   
  2 127789.3000000              3.78849539D-06   
  3  47823.6340000              2.02937360D-05   
  4  19394.0760000              8.89987274D-05   
  5   8404.2078000              3.51018263D-04   
  6   3841.4461000              1.24106264D-03   
  7   1830.8483000              3.94481581D-03   
  8    900.9006100              1.10798135D-02   
  9    453.9605200              2.57269573D-02   
 10    232.7207100              4.34721516D-02   
 11    120.7602100              2.85430199D-02   
 12     63.1866630             -7.25133704D-02   
 13     33.2450730             -2.02196800D-01   
 14     17.5537630             -4.41670676D-02   
 15      9.2889135              2.96653045D-01   
 16      4.9217725              3.88820870D-01   
 17      2.6097127             -5.78850210D-02   
 18      1.3842960             -4.97667984D-01   
 19      0.73442114            -4.59026307D-01   
 20      0.38966943            -1.63126224D-01   
 21      0.20675729            -2.96354837D-02   
D   18
  1   8404.2078000              9.43910793D-05   
  2   3841.4461000              3.49343654D-04   
  3   1830.8483000              1.80908562D-03   
  4    900.9006100              7.61849059D-03   
  5    453.9605200              2.82199402D-02   
  6    232.7207100              8.77860162D-02   
  7    120.7602100              2.10827896D-01   
  8     63.1866630              3.54333868D-01   
  9     33.2450730              3.47124767D-01   
 10     17.5537630              1.49109586D-01   
 11      9.2889135              2.31756677D-02   
 12      4.9217725              1.35134798D-03   
 13      2.6097127              2.90042327D-04   
 14      1.3842960             -4.96593441D-05   
 15      0.73442114             3.84611690D-05   
 16      0.38966943            -2.91591941D-05   
 17      0.20675729             1.03704143D-05   
 18      0.10970579            -4.17783894D-06   
D   18
  1   8404.2078000             -4.72274507D-05   
  2   3841.4461000             -1.78540494D-04   
  3   1830.8483000             -9.10777314D-04   
  4    900.9006100             -3.90492475D-03   
  5    453.9605200             -1.44840716D-02   
  6    232.7207100             -4.61336030D-02   
  7    120.7602100             -1.12285417D-01   
  8     63.1866630             -1.86152883D-01   
  9     33.2450730             -1.29842713D-01   
 10     17.5537630              1.73773155D-01   
 11      9.2889135              4.41364291D-01   
 12      4.9217725              3.86359640D-01   
 13      2.6097127              1.37589665D-01   
 14      1.3842960              1.92537065D-02   
 15      0.73442114             9.95303891D-04   
 16      0.38966943             4.27093343D-04   
 17      0.20675729            -6.66052905D-05   
 18      0.10970579             5.56972246D-05   
D   18
  1   8404.2078000              1.37788342D-05   
  2   3841.4461000              5.27444990D-05   
  3   1830.8483000              2.66190104D-04   
  4    900.9006100              1.15091244D-03   
  5    453.9605200              4.25442558D-03   
  6    232.7207100              1.36429321D-02   
  7    120.7602100              3.31987430D-02   
  8     63.1866630              5.51034979D-02   
  9     33.2450730              3.45975539D-02   
 10     17.5537630             -6.88004881D-02   
 11      9.2889135             -1.59149033D-01   
 12      4.9217725             -1.28446613D-01   
 13      2.6097127              7.70575365D-02   
 14      1.3842960              2.95107436D-01   
 15      0.73442114             3.57834991D-01   
 16      0.38966943             2.92570876D-01   
 17      0.20675729             1.45520617D-01   
 18      0.10970579             5.76295295D-02   
F   12
  1    900.9006100              1.87895825D-04   
  2    453.9605200              7.69440207D-04   
  3    232.7207100              3.93113554D-03   
  4    120.7602100              1.65362192D-02   
  5     63.1866630              5.39939558D-02   
  6     33.2450730              1.38492965D-01   
  7     17.5537630              2.53311485D-01   
  8      9.2889135              3.20010187D-01   
  9      4.9217725              2.90543840D-01   
 10      2.6097127              1.79767371D-01   
 11      1.3842960              6.86732579D-02   
 12      0.73442114             1.89478008D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Pt
data:
PLATINUM
S   28
  1 97069151.0000000            2.37020879D-06   
  2 20323110.0000000            1.26998799D-05   
  3 4876833.2000000             7.11151091D-05   
  4 1328855.7000000             3.26711374D-04   
  5 406753.5500000              1.30559696D-03   
  6 138201.1600000              4.56029489D-03   
  7  51463.8230000              1.41178668D-02   
  8  20733.4110000              3.88558214D-02   
  9   8922.7141000              9.41065542D-02   
 10   4053.0081000              1.92965716D-01   
 11   1922.1628000              3.07373665D-01   
 12    942.7584800              3.18020227D-01   
 13    474.3600500              1.54960439D-01   
 14    243.2441900              1.94974956D-02   
 15    126.4500400              1.17454869D-03   
 16     66.3699520             -6.79682059D-04   
 17     35.0649750              4.80582415D-04   
 18     18.6061970             -4.16686309D-04   
 19      9.9001060              3.16266282D-04   
 20      5.2765871             -2.27743054D-04   
 21      2.8150788              1.68005733D-04   
 22      1.5026560             -1.20941504D-04   
 23      0.80231679             8.45453334D-05   
 24      0.42843613            -5.71682976D-05   
 25      0.22879584             3.59675310D-05   
 26      0.12218490            -1.98074300D-05   
 27      0.65251259E-01         8.37638599D-06   
 28      0.34846613E-01        -1.97490357D-06   
S   28
  1 97069151.0000000            7.88766984D-07   
  2 20323110.0000000            4.22558057D-06   
  3 4876833.2000000             2.36704146D-05   
  4 1328855.7000000             1.08758005D-04   
  5 406753.5500000              4.35291689D-04   
  6 138201.1600000              1.52512200D-03   
  7  51463.8230000              4.76549355D-03   
  8  20733.4110000              1.33826592D-02   
  9   8922.7141000              3.39405974D-02   
 10   4053.0081000              7.63343188D-02   
 11   1922.1628000              1.45994102D-01   
 12    942.7584800              2.05750220D-01   
 13    474.3600500              1.21260406D-01   
 14    243.2441900             -2.57924876D-01   
 15    126.4500400             -5.84291463D-01   
 16     66.3699520             -3.26385230D-01   
 17     35.0649750             -3.43828562D-02   
 18     18.6061970             -2.65953871D-03   
 19      9.9001060              1.77478028D-03   
 20      5.2765871             -1.06187743D-03   
 21      2.8150788              8.41169314D-04   
 22      1.5026560             -6.12576456D-04   
 23      0.80231679             4.20438477D-04   
 24      0.42843613            -2.86826108D-04   
 25      0.22879584             1.80129599D-04   
 26      0.12218490            -9.92106917D-05   
 27      0.65251259E-01         4.19448419D-05   
 28      0.34846613E-01        -9.88694331D-06   
S   28
  1 97069151.0000000            3.73412082D-07   
  2 20323110.0000000            2.00011815D-06   
  3 4876833.2000000             1.12065476D-05   
  4 1328855.7000000             5.14819670D-05   
  5 406753.5500000              2.06143552D-04   
  6 138201.1600000              7.22421005D-04   
  7  51463.8230000              2.26123086D-03   
  8  20733.4110000              6.36735707D-03   
  9   8922.7141000              1.62722730D-02   
 10   4053.0081000              3.71085516D-02   
 11   1922.1628000              7.31878719D-02   
 12    942.7584800              1.08843974D-01   
 13    474.3600500              7.07506881D-02   
 14    243.2441900             -1.89590679D-01   
 15    126.4500400             -5.91604932D-01   
 16     66.3699520             -4.02728175D-01   
 17     35.0649750              6.38190326D-01   
 18     18.6061970              7.16502581D-01   
 19      9.9001060              1.16804252D-01   
 20      5.2765871              1.77625323D-02   
 21      2.8150788             -8.70288227D-03   
 22      1.5026560              6.64504865D-03   
 23      0.80231679            -4.98739911D-03   
 24      0.42843613             3.37806395D-03   
 25      0.22879584            -2.16173247D-03   
 26      0.12218490             1.19881731D-03   
 27      0.65251259E-01        -5.09374159D-04   
 28      0.34846613E-01         1.20429897D-04   
S   28
  1 97069151.0000000            1.84836236D-07   
  2 20323110.0000000            9.89356285D-07   
  3 4876833.2000000             5.54809153D-06   
  4 1328855.7000000             2.54636967D-05   
  5 406753.5500000              1.02077246D-04   
  6 138201.1600000              3.57309620D-04   
  7  51463.8230000              1.12052983D-03   
  8  20733.4110000              3.15150769D-03   
  9   8922.7141000              8.08772403D-03   
 10   4053.0081000              1.84487558D-02   
 11   1922.1628000              3.68154076D-02   
 12    942.7584800              5.50899085D-02   
 13    474.3600500              3.75907535D-02   
 14    243.2441900             -1.05961226D-01   
 15    126.4500400             -3.49519461D-01   
 16     66.3699520             -2.82353346D-01   
 17     35.0649750              6.29774368D-01   
 18     18.6061970              9.73296993D-01   
 19      9.9001060             -2.89746314D-01   
 20      5.2765871             -9.48039161D-01   
 21      2.8150788             -3.18701918D-01   
 22      1.5026560             -8.21447813D-03   
 23      0.80231679            -8.13395052D-03   
 24      0.42843613             3.71138518D-03   
 25      0.22879584            -2.52588324D-03   
 26      0.12218490             1.36205144D-03   
 27      0.65251259E-01        -5.78254986D-04   
 28      0.34846613E-01         1.36754282D-04   
S   28
  1 97069151.0000000           -7.74741629D-08   
  2 20323110.0000000           -4.14426436D-07   
  3 4876833.2000000            -2.32583187D-06   
  4 1328855.7000000            -1.06655349D-05   
  5 406753.5500000             -4.27981983D-05   
  6 138201.1600000             -1.49638743D-04   
  7  51463.8230000             -4.69977798D-04   
  8  20733.4110000             -1.31969779D-03   
  9   8922.7141000             -3.39577903D-03   
 10   4053.0081000             -7.72948450D-03   
 11   1922.1628000             -1.55139575D-02   
 12    942.7584800             -2.31345706D-02   
 13    474.3600500             -1.61991820D-02   
 14    243.2441900              4.61148744D-02   
 15    126.4500400              1.51700405D-01   
 16     66.3699520              1.31505609D-01   
 17     35.0649750             -3.17091472D-01   
 18     18.6061970             -5.03306167D-01   
 19      9.9001060              1.71851009D-01   
 20      5.2765871              9.00222755D-01   
 21      2.8150788              4.28818437D-01   
 22      1.5026560             -6.44584716D-01   
 23      0.80231679            -6.80469413D-01   
 24      0.42843613            -2.21346343D-01   
 25      0.22879584            -3.77637675D-03   
 26      0.12218490            -6.91621736D-03   
 27      0.65251259E-01         2.78416008D-03   
 28      0.34846613E-01        -6.76756289D-04   
S   28
  1 97069151.0000000            2.01350354D-08   
  2 20323110.0000000            1.07677493D-07   
  3 4876833.2000000             6.04507257D-07   
  4 1328855.7000000             2.77105544D-06   
  5 406753.5500000              1.11243225D-05   
  6 138201.1600000              3.88754469D-05   
  7  51463.8230000              1.22174517D-04   
  8  20733.4110000              3.42813367D-04   
  9   8922.7141000              8.83024775D-04   
 10   4053.0081000              2.00766002D-03   
 11   1922.1628000              4.03776329D-03   
 12    942.7584800              6.00721238D-03   
 13    474.3600500              4.24537288D-03   
 14    243.2441900             -1.20965742D-02   
 15    126.4500400             -3.95593287D-02   
 16     66.3699520             -3.49519401D-02   
 17     35.0649750              8.52885957D-02   
 18     18.6061970              1.34473840D-01   
 19      9.9001060             -4.45185823D-02   
 20      5.2765871             -2.75408115D-01   
 21      2.8150788             -1.26500504D-01   
 22      1.5026560              2.38775926D-01   
 23      0.80231679             3.46364956D-01   
 24      0.42843613             1.79990056D-01   
 25      0.22879584            -2.69001726D-02   
 26      0.12218490            -4.25163684D-01   
 27      0.65251259E-01        -3.96349236D-01   
 28      0.34846613E-01        -3.63685947D-01   
P   21
  1 406753.5500000              7.78717572D-06   
  2 138201.1600000              3.69614533D-05   
  3  51463.8230000              1.99875392D-04   
  4  20733.4110000              8.86414264D-04   
  5   8922.7141000              3.52024296D-03   
  6   4053.0081000              1.24299897D-02   
  7   1922.1628000              3.88590227D-02   
  8    942.7584800              1.04819393D-01   
  9    474.3600500              2.27264812D-01   
 10    243.2441900              3.52784246D-01   
 11    126.4500400              3.11187027D-01   
 12     66.3699520              1.12435182D-01   
 13     35.0649750              9.51498188D-03   
 14     18.6061970              4.65321853D-04   
 15      9.9001060             -3.25786187D-04   
 16      5.2765871              1.03689651D-04   
 17      2.8150788             -9.15930548D-05   
 18      1.5026560              5.95701946D-05   
 19      0.80231679            -3.04018140D-05   
 20      0.42843613             1.47541327D-05   
 21      0.22879584            -3.62796480D-06   
P   21
  1 406753.5500000             -3.91358009D-06   
  2 138201.1600000             -1.85088419D-05   
  3  51463.8230000             -1.00566542D-04   
  4  20733.4110000             -4.45597345D-04   
  5   8922.7141000             -1.78255291D-03   
  6   4053.0081000             -6.34270104D-03   
  7   1922.1628000             -2.02590315D-02   
  8    942.7584800             -5.65690632D-02   
  9    474.3600500             -1.30077356D-01   
 10    243.2441900             -2.16127016D-01   
 11    126.4500400             -1.62439496D-01   
 12     66.3699520              2.05682857D-01   
 13     35.0649750              5.62608263D-01   
 14     18.6061970              3.37236065D-01   
 15      9.9001060              5.12195309D-02   
 16      5.2765871              4.51417377D-03   
 17      2.8150788             -1.10043214D-03   
 18      1.5026560              7.91739039D-04   
 19      0.80231679            -5.24809482D-04   
 20      0.42843613             2.21427729D-04   
 21      0.22879584            -6.20022298D-05   
P   21
  1 406753.5500000              1.91540221D-06   
  2 138201.1600000              9.09228957D-06   
  3  51463.8230000              4.92402477D-05   
  4  20733.4110000              2.18896739D-04   
  5   8922.7141000              8.74605778D-04   
  6   4053.0081000              3.12534509D-03   
  7   1922.1628000              1.00112886D-02   
  8    942.7584800              2.82416359D-02   
  9    474.3600500              6.57492115D-02   
 10    243.2441900              1.11633694D-01   
 11    126.4500400              7.83993570D-02   
 12     66.3699520             -1.61687975D-01   
 13     35.0649750             -4.65793620D-01   
 14     18.6061970             -1.72439066D-01   
 15      9.9001060              4.92607333D-01   
 16      5.2765871              5.71007873D-01   
 17      2.8150788              1.67341570D-01   
 18      1.5026560              1.22945205D-02   
 19      0.80231679             1.13247075D-03   
 20      0.42843613             1.47879712D-04   
 21      0.22879584            -1.93371369D-05   
P   21
  1 406753.5500000              7.46662952D-07   
  2 138201.1600000              3.55613960D-06   
  3  51463.8230000              1.91981798D-05   
  4  20733.4110000              8.55718966D-05   
  5   8922.7141000              3.41264162D-04   
  6   4053.0081000              1.22227917D-03   
  7   1922.1628000              3.91305333D-03   
  8    942.7584800              1.10751743D-02   
  9    474.3600500              2.58263506D-02   
 10    243.2441900              4.41177101D-02   
 11    126.4500400              3.03928662D-02   
 12     66.3699520             -6.91964005D-02   
 13     35.0649750             -2.04306661D-01   
 14     18.6061970             -5.79765942D-02   
 15      9.9001060              2.88528860D-01   
 16      5.2765871              4.06572293D-01   
 17      2.8150788             -3.54458799D-02   
 18      1.5026560             -4.91869230D-01   
 19      0.80231679            -4.67306158D-01   
 20      0.42843613            -1.73349053D-01   
 21      0.22879584            -3.34573873D-02   
D   18
  1   8922.7141000              8.81841133D-05   
  2   4053.0081000              3.34395277D-04   
  3   1922.1628000              1.74292845D-03   
  4    942.7584800              7.39172779D-03   
  5    474.3600500              2.75007035D-02   
  6    243.2441900              8.57094251D-02   
  7    126.4500400              2.06599616D-01   
  8     66.3699520              3.49779289D-01   
  9     35.0649750              3.49183412D-01   
 10     18.6061970              1.55800956D-01   
 11      9.9001060              2.56282826D-02   
 12      5.2765871              1.55260382D-03   
 13      2.8150788              2.78751899D-04   
 14      1.5026560             -3.79223738D-05   
 15      0.80231679             2.60380240D-05   
 16      0.42843613            -2.46994064D-05   
 17      0.22879584             6.59756092D-06   
 18      0.12218490            -3.64533828D-06   
D   18
  1   8922.7141000             -4.44666234D-05   
  2   4053.0081000             -1.71910105D-04   
  3   1922.1628000             -8.84288493D-04   
  4    942.7584800             -3.81343639D-03   
  5    474.3600500             -1.42184746D-02   
  6    243.2441900             -4.53414728D-02   
  7    126.4500400             -1.10867647D-01   
  8     66.3699520             -1.85425807D-01   
  9     35.0649750             -1.35696782D-01   
 10     18.6061970              1.60489766D-01   
 11      9.9001060              4.35391714D-01   
 12      5.2765871              3.94149449D-01   
 13      2.8150788              1.45093324D-01   
 14      1.5026560              2.10259523D-02   
 15      0.80231679             1.27191870D-03   
 16      0.42843613             4.94514108D-04   
 17      0.22879584            -1.13875787D-05   
 18      0.12218490             6.91100662D-05   
D   18
  1   8922.7141000              1.33931742D-05   
  2   4053.0081000              5.23936747D-05   
  3   1922.1628000              2.66825037D-04   
  4    942.7584800              1.15986601D-03   
  5    474.3600500              4.31129767D-03   
  6    243.2441900              1.38398098D-02   
  7    126.4500400              3.38436388D-02   
  8     66.3699520              5.66765601D-02   
  9     35.0649750              3.76829058D-02   
 10     18.6061970             -6.68230332D-02   
 11      9.9001060             -1.63115175D-01   
 12      5.2765871             -1.37686669D-01   
 13      2.8150788              7.29492975D-02   
 14      1.5026560              2.97326826D-01   
 15      0.80231679             3.56657593D-01   
 16      0.42843613             2.92060679D-01   
 17      0.22879584             1.44566627D-01   
 18      0.12218490             6.06908947D-02   
F   12
  1    942.7584800              1.84878615D-04   
  2    474.3600500              7.62365431D-04   
  3    243.2441900              3.89455753D-03   
  4    126.4500400              1.63559651D-02   
  5     66.3699520              5.34283392D-02   
  6     35.0649750              1.37098219D-01   
  7     18.6061970              2.51896910D-01   
  8      9.9001060              3.20289633D-01   
  9      5.2765871              2.91535127D-01   
 10      2.8150788              1.78548318D-01   
 11      1.5026560              6.65558951D-02   
 12      0.80231679             1.79704250D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Au
data:
GOLD
S   28
  1 103551660.0000000           2.27539465D-06   
  2 21175219.0000000            1.26496489D-05   
  3 5001590.6000000             7.17414541D-05   
  4 1350617.9000000             3.32165108D-04   
  5 412024.2900000              1.32745187D-03   
  6 140132.8500000              4.61440787D-03   
  7  52396.3380000              1.41708258D-02   
  8  21234.2880000              3.86461078D-02   
  9   9199.4532000              9.28268417D-02   
 10   4206.2952000              1.89468269D-01   
 11   2006.6241000              3.02629854D-01   
 12    988.9349200              3.18433197D-01   
 13    499.3845400              1.61455484D-01   
 14    256.6822700              2.21215938D-02   
 15    133.6009200              1.18749788D-03   
 16     70.1422110             -6.33438681D-04   
 17     37.0389810              4.54491384D-04   
 18     19.6317620             -4.00820030D-04   
 19     10.4295780              3.03781716D-04   
 20      5.5484649             -2.17999527D-04   
 21      2.9540414              1.60645984D-04   
 22      1.5733993             -1.15414938D-04   
 23      0.83820185             8.04860258D-05   
 24      0.44657751            -5.43274703D-05   
 25      0.23793590             3.41387056D-05   
 26      0.12677333            -1.87956532D-05   
 27      0.67545585E-01         7.95544120D-06   
 28      0.35988705E-01        -1.87913197D-06   
S   28
  1 103551660.0000000           7.57710035D-07   
  2 21175219.0000000            4.21166173D-06   
  3 5001590.6000000             2.38944757D-05   
  4 1350617.9000000             1.10647406D-04   
  5 412024.2900000              4.42878229D-04   
  6 140132.8500000              1.54433675D-03   
  7  52396.3380000              4.78706582D-03   
  8  21234.2880000              1.33201264D-02   
  9   9199.4532000              3.34895832D-02   
 10   4206.2952000              7.48603798D-02   
 11   2006.6241000              1.43035357D-01   
 12    988.9349200              2.03799000D-01   
 13    499.3845400              1.28855123D-01   
 14    256.6822700             -2.37404521D-01   
 15    133.6009200             -5.81277027D-01   
 16     70.1422110             -3.45031568D-01   
 17     37.0389810             -3.95777917D-02   
 18     19.6317620             -2.87123766D-03   
 19     10.4295780              1.91163747D-03   
 20      5.5484649             -1.18469403D-03   
 21      2.9540414              9.42586809D-04   
 22      1.5733993             -6.88999860D-04   
 23      0.83820185             4.74733665D-04   
 24      0.44657751            -3.23868593D-04   
 25      0.23793590             2.03648285D-04   
 26      0.12677333            -1.12314834D-04   
 27      0.67545585E-01         4.75836448D-05   
 28      0.35988705E-01        -1.12466325D-05   
S   28
  1 103551660.0000000           3.59232844D-07   
  2 21175219.0000000            1.99633936D-06   
  3 5001590.6000000             1.13292700D-05   
  4 1350617.9000000             5.24497248D-05   
  5 412024.2900000              2.10048778D-04   
  6 140132.8500000              7.32539915D-04   
  7  52396.3380000              2.27495854D-03   
  8  21234.2880000              6.34622742D-03   
  9   9199.4532000              1.60807643D-02   
 10   4206.2952000              3.64292957D-02   
 11   2006.6241000              7.17658381D-02   
 12    988.9349200              1.07707058D-01   
 13    499.3845400              7.51171113D-02   
 14    256.6822700             -1.73497595D-01   
 15    133.6009200             -5.79880623D-01   
 16     70.1422110             -4.36028866D-01   
 17     37.0389810              6.04186095D-01   
 18     19.6317620              7.41880026D-01   
 19     10.4295780              1.28911349D-01   
 20      5.5484649              1.85890825D-02   
 21      2.9540414             -9.00812494D-03   
 22      1.5733993              6.89258090D-03   
 23      0.83820185            -5.18656225D-03   
 24      0.44657751             3.51730058D-03   
 25      0.23793590            -2.25238223D-03   
 26      0.12677333             1.25060129D-03   
 27      0.67545585E-01        -5.32328965D-04   
 28      0.35988705E-01         1.26163154D-04   
S   28
  1 103551660.0000000           1.78454506D-07   
  2 21175219.0000000            9.91041961D-07   
  3 5001590.6000000             5.62891219D-06   
  4 1350617.9000000             2.60355939D-05   
  5 412024.2900000              1.04384186D-04   
  6 140132.8500000              3.63612072D-04   
  7  52396.3380000              1.13140912D-03   
  8  21234.2880000              3.15222387D-03   
  9   9199.4532000              8.02171142D-03   
 10   4206.2952000              1.81739406D-02   
 11   2006.6241000              3.62275201D-02   
 12    988.9349200              5.46838780D-02   
 13    499.3845400              3.99686069D-02   
 14    256.6822700             -9.72264077D-02   
 15    133.6009200             -3.42689802D-01   
 16     70.1422110             -3.04379201D-01   
 17     37.0389810              5.92492358D-01   
 18     19.6317620              1.00479768D+00   
 19     10.4295780             -2.47498480D-01   
 20      5.5484649             -9.65695585D-01   
 21      2.9540414             -3.30163320D-01   
 22      1.5733993             -8.51315548D-03   
 23      0.83820185            -8.37024125D-03   
 24      0.44657751             3.78099042D-03   
 25      0.23793590            -2.56366105D-03   
 26      0.12677333             1.38053427D-03   
 27      0.67545585E-01        -5.86315294D-04   
 28      0.35988705E-01         1.38893995D-04   
S   28
  1 103551660.0000000          -7.56266228D-08   
  2 21175219.0000000           -4.19707253D-07   
  3 5001590.6000000            -2.38583609D-06   
  4 1350617.9000000            -1.10250952D-05   
  5 412024.2900000             -4.42508973D-05   
  6 140132.8500000             -1.53949323D-04   
  7  52396.3380000             -4.79827903D-04   
  8  21234.2880000             -1.33440469D-03   
  9   9199.4532000             -3.40588146D-03   
 10   4206.2952000             -7.69665293D-03   
 11   2006.6241000             -1.54396065D-02   
 12    988.9349200             -2.32059698D-02   
 13    499.3845400             -1.74188637D-02   
 14    256.6822700              4.28677880D-02   
 15    133.6009200              1.50195056D-01   
 16     70.1422110              1.43131966D-01   
 17     37.0389810             -3.02035447D-01   
 18     19.6317620             -5.25551011D-01   
 19     10.4295780              1.45614842D-01   
 20      5.5484649              9.28094087D-01   
 21      2.9540414              4.42747884D-01   
 22      1.5733993             -6.65370755D-01   
 23      0.83820185            -6.77968883D-01   
 24      0.44657751            -2.15642572D-01   
 25      0.23793590            -2.02943919D-03   
 26      0.12677333            -7.30554390D-03   
 27      0.67545585E-01         2.97932732D-03   
 28      0.35988705E-01        -7.26008350D-04   
S   28
  1 103551660.0000000           1.95189490D-08   
  2 21175219.0000000            1.08294137D-07   
  3 5001590.6000000             6.15816311D-07   
  4 1350617.9000000             2.84461603D-06   
  5 412024.2900000              1.14224963D-05   
  6 140132.8500000              3.97175754D-05   
  7  52396.3380000              1.23876086D-04   
  8  21234.2880000              3.44218896D-04   
  9   9199.4532000              8.79581263D-04   
 10   4206.2952000              1.98513670D-03   
 11   2006.6241000              3.99108791D-03   
 12    988.9349200              5.98315548D-03   
 13    499.3845400              4.53372496D-03   
 14    256.6822700             -1.11765868D-02   
 15    133.6009200             -3.88879937D-02   
 16     70.1422110             -3.77727739D-02   
 17     37.0389810              8.07715727D-02   
 18     19.6317620              1.39566998D-01   
 19     10.4295780             -3.68868782D-02   
 20      5.5484649             -2.82728503D-01   
 21      2.9540414             -1.29376338D-01   
 22      1.5733993              2.47302518D-01   
 23      0.83820185             3.43263094D-01   
 24      0.44657751             1.73294333D-01   
 25      0.23793590            -3.15570706D-02   
 26      0.12677333            -4.22872510D-01   
 27      0.67545585E-01        -3.92755275D-01   
 28      0.35988705E-01        -3.63799889D-01   
P   21
  1 412024.2900000              7.97388443D-06   
  2 140132.8500000              3.76532655D-05   
  3  52396.3380000              2.01678502D-04   
  4  21234.2880000              8.83448999D-04   
  5   9199.4532000              3.46536673D-03   
  6   4206.2952000              1.21115847D-02   
  7   2006.6241000              3.75968931D-02   
  8    988.9349200              1.01279536D-01   
  9    499.3845400              2.20879934D-01   
 10    256.6822700              3.48638900D-01   
 11    133.6009200              3.17337949D-01   
 12     70.1422110              1.20394338D-01   
 13     37.0389810              1.09101807D-02   
 14     19.6317620              5.52966842D-04   
 15     10.4295780             -3.82766283D-04   
 16      5.5484649              1.45454873D-04   
 17      2.9540414             -1.22110323D-04   
 18      1.5733993              8.05422170D-05   
 19      0.83820185            -4.21145976D-05   
 20      0.44657751             2.02677227D-05   
 21      0.23793590            -5.06840249D-06   
P   21
  1 412024.2900000             -4.01324821D-06   
  2 140132.8500000             -1.88972582D-05   
  3  52396.3380000             -1.01628279D-04   
  4  21234.2880000             -4.45021912D-04   
  5   9199.4532000             -1.75757626D-03   
  6   4206.2952000             -6.19146938D-03   
  7   2006.6241000             -1.96232091D-02   
  8    988.9349200             -5.46971561D-02   
  9    499.3845400             -1.26352160D-01   
 10    256.6822700             -2.13649743D-01   
 11    133.6009200             -1.70738647D-01   
 12     70.1422110              1.85995185D-01   
 13     37.0389810              5.60238820D-01   
 14     19.6317620              3.52971938D-01   
 15     10.4295780              5.56935658D-02   
 16      5.5484649              4.99717122D-03   
 17      2.9540414             -1.33427717D-03   
 18      1.5733993              9.40434052D-04   
 19      0.83820185            -6.23988794D-04   
 20      0.44657751             2.65693004D-04   
 21      0.23793590            -7.43989258D-05   
P   21
  1 412024.2900000              1.97185564D-06   
  2 140132.8500000              9.32871558D-06   
  3  52396.3380000              4.99542428D-05   
  4  21234.2880000              2.19654301D-04   
  5   9199.4532000              8.65811322D-04   
  6   4206.2952000              3.06498449D-03   
  7   2006.6241000              9.73580473D-03   
  8    988.9349200              2.74268931D-02   
  9    499.3845400              6.40990701D-02   
 10    256.6822700              1.10838903D-01   
 11    133.6009200              8.37113559D-02   
 12     70.1422110             -1.48670870D-01   
 13     37.0389810             -4.64996484D-01   
 14     19.6317620             -1.97026613D-01   
 15     10.4295780              4.83321914D-01   
 16      5.5484649              5.83314676D-01   
 17      2.9540414              1.71695531D-01   
 18      1.5733993              1.23812414D-02   
 19      0.83820185             1.21675868D-03   
 20      0.44657751             1.42677600D-04   
 21      0.23793590            -1.07766665D-05   
P   21
  1 412024.2900000              7.79053158D-07   
  2 140132.8500000              3.70106132D-06   
  3  52396.3380000              1.97394960D-05   
  4  21234.2880000              8.70910146D-05   
  5   9199.4532000              3.42427543D-04   
  6   4206.2952000              1.21565255D-03   
  7   2006.6241000              3.85737540D-03   
  8    988.9349200              1.09074222D-02   
  9    499.3845400              2.55220396D-02   
 10    256.6822700              4.44278975D-02   
 11    133.6009200              3.29800076D-02   
 12     70.1422110             -6.46192941D-02   
 13     37.0389810             -2.07076680D-01   
 14     19.6317620             -7.08983797D-02   
 15     10.4295780              2.88498202D-01   
 16      5.5484649              4.23209225D-01   
 17      2.9540414             -3.71984602D-02   
 18      1.5733993             -5.04695128D-01   
 19      0.83820185            -4.64379023D-01   
 20      0.44657751            -1.67478011D-01   
 21      0.23793590            -3.06446258D-02   
D   18
  1   9199.4532000              8.76905754D-05   
  2   4206.2952000              3.23693700D-04   
  3   2006.6241000              1.67915064D-03   
  4    988.9349200              7.06058204D-03   
  5    499.3845400              2.62657123D-02   
  6    256.6822700              8.22630536D-02   
  7    133.6009200              2.00737337D-01   
  8     70.1422110              3.46041276D-01   
  9     37.0389810              3.54240005D-01   
 10     19.6317620              1.63042941D-01   
 11     10.4295780              2.74116899D-02   
 12      5.5484649              1.72164482D-03   
 13      2.9540414              2.07864485D-04   
 14      1.5733993              2.20550737D-06   
 15      0.83820185            -1.02030842D-05   
 16      0.44657751            -8.43411698D-06   
 17      0.23793590            -3.88856144D-06   
 18      0.12677333            -1.41532769D-06   
D   18
  1   9199.4532000             -4.45465377D-05   
  2   4206.2952000             -1.67476992D-04   
  3   2006.6241000             -8.58004906D-04   
  4    988.9349200             -3.66644731D-03   
  5    499.3845400             -1.36723291D-02   
  6    256.6822700             -4.37858743D-02   
  7    133.6009200             -1.08487689D-01   
  8     70.1422110             -1.85167322D-01   
  9     37.0389810             -1.42909456D-01   
 10     19.6317620              1.50776719D-01   
 11     10.4295780              4.36656100D-01   
 12      5.5484649              4.00511245D-01   
 13      2.9540414              1.45695620D-01   
 14      1.5733993              2.05380503D-02   
 15      0.83820185             1.38196992D-03   
 16      0.44657751             6.12030555D-04   
 17      0.23793590             5.31822836D-05   
 18      0.12677333             8.90569392D-05   
D   18
  1   9199.4532000              1.38140033D-05   
  2   4206.2952000              5.25490862D-05   
  3   2006.6241000              2.66519290D-04   
  4    988.9349200              1.14805724D-03   
  5    499.3845400              4.26800600D-03   
  6    256.6822700              1.37590863D-02   
  7    133.6009200              3.41019710D-02   
  8     70.1422110              5.82972875D-02   
  9     37.0389810              4.12536670D-02   
 10     19.6317620             -6.58102268D-02   
 11     10.4295780             -1.69457499D-01   
 12      5.5484649             -1.45007907D-01   
 13      2.9540414              8.03205676D-02   
 14      1.5733993              3.10091877D-01   
 15      0.83820185             3.60307348D-01   
 16      0.44657751             2.84206868D-01   
 17      0.23793590             1.36965088D-01   
 18      0.12677333             5.32472216D-02   
F   12
  1    988.9349200              1.79665420D-04   
  2    499.3845400              7.34863870D-04   
  3    256.6822700              3.75826700D-03   
  4    133.6009200              1.58853555D-02   
  5     70.1422110              5.24984715D-02   
  6     37.0389810              1.36310041D-01   
  7     19.6317620              2.53422985D-01   
  8     10.4295780              3.24464138D-01   
  9      5.5484649              2.93879423D-01   
 10      2.9540414              1.74414191D-01   
 11      1.5733993              6.18198480D-02   
 12      0.83820185             1.52639836D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Hg
data:
MERCURY
S   29
  1 96293620.0000000            2.57855259D-06   
  2 19555636.0000000            1.44726738D-05   
  3 4607673.0000000             8.20525995D-05   
  4 1245720.3000000             3.78382538D-04   
  5 381541.5300000              1.50071886D-03   
  6 130537.1300000              5.16432204D-03   
  7  49154.8270000              1.56716338D-02   
  8  20071.1270000              4.21528729D-02   
  9   8760.5591000              9.95980291D-02   
 10   4033.8159000              1.99013254D-01   
 11   1936.6618000              3.08481558D-01   
 12    959.8958000              3.09980224D-01   
 13    487.1595800              1.46386430D-01   
 14    251.5140500              1.77701531D-02   
 15    131.4338200              1.08394461D-03   
 16     69.2566110             -6.26123147D-04   
 17     36.6964560              4.29733846D-04   
 18     19.5139200             -3.72286142D-04   
 19     10.4000870              2.82129278D-04   
 20      5.5502436             -2.02146119D-04   
 21      2.9642867              1.49485057D-04   
 22      1.5838295             -1.08516717D-04   
 23      0.84642317             7.71156078D-05   
 24      0.45238567            -5.39435589D-05   
 25      0.24179521             3.62814727D-05   
 26      0.12923879            -2.27693136D-05   
 27      0.69078028E-01         1.25078835D-05   
 28      0.36922185E-01        -5.27830816D-06   
 29      0.19734899E-01         1.24215421D-06   
S   29
  1 96293620.0000000            8.59206270D-07   
  2 19555636.0000000            4.82180098D-06   
  3 4607673.0000000             2.73463918D-05   
  4 1245720.3000000             1.26133214D-04   
  5 381541.5300000              5.01097018D-04   
  6 130537.1300000              1.73044632D-03   
  7  49154.8270000              5.30438029D-03   
  8  20071.1270000              1.45814898D-02   
  9   8760.5591000              3.61740625D-02   
 10   4033.8159000              7.96073468D-02   
 11   1936.6618000              1.48933705D-01   
 12    959.8958000              2.04423929D-01   
 13    487.1595800              1.11766600D-01   
 14    251.5140500             -2.69817478D-01   
 15    131.4338200             -5.82150020D-01   
 16     69.2566110             -3.17779205D-01   
 17     36.6964560             -3.23526735D-02   
 18     19.5139200             -2.60155606D-03   
 19     10.4000870              1.76970285D-03   
 20      5.5502436             -1.05394418D-03   
 21      2.9642867              8.29633826D-04   
 22      1.5838295             -6.11334893D-04   
 23      0.84642317             4.27012171D-04   
 24      0.45238567            -3.01471342D-04   
 25      0.24179521             2.02751860D-04   
 26      0.12923879            -1.27415544D-04   
 27      0.69078028E-01         7.00499623D-05   
 28      0.36922185E-01        -2.95762871D-05   
 29      0.19734899E-01         6.96224604D-06   
S   29
  1 96293620.0000000            4.07904885D-07   
  2 19555636.0000000            2.28890120D-06   
  3 4607673.0000000             1.29832355D-05   
  4 1245720.3000000             5.98795569D-05   
  5 381541.5300000              2.37978823D-04   
  6 130537.1300000              8.22131302D-04   
  7  49154.8270000              2.52450817D-03   
  8  20071.1270000              6.96140923D-03   
  9   8760.5591000              1.74071707D-02   
 10   4033.8159000              3.88794081D-02   
 11   1936.6618000              7.50681509D-02   
 12    959.8958000              1.08921280D-01   
 13    487.1595800              6.56168038D-02   
 14    251.5140500             -2.00532285D-01   
 15    131.4338200             -5.98048322D-01   
 16     69.2566110             -3.87240554D-01   
 17     36.6964560              6.55976369D-01   
 18     19.5139200              7.04551931D-01   
 19     10.4000870              1.12473663D-01   
 20      5.5502436              1.63701200D-02   
 21      2.9642867             -8.16947885D-03   
 22      1.5838295              6.19438527D-03   
 23      0.84642317            -4.75214704D-03   
 24      0.45238567             3.33270726D-03   
 25      0.24179521            -2.28177990D-03   
 26      0.12923879             1.44391553D-03   
 27      0.69078028E-01        -7.97740365D-04   
 28      0.36922185E-01         3.37840638D-04   
 29      0.19734899E-01        -7.96748257D-05   
S   29
  1 96293620.0000000           -2.03342085D-07   
  2 19555636.0000000           -1.14038834D-06   
  3 4607673.0000000            -6.47309035D-06   
  4 1245720.3000000            -2.98315919D-05   
  5 381541.5300000             -1.18673802D-04   
  6 130537.1300000             -4.09581112D-04   
  7  49154.8270000             -1.25988449D-03   
  8  20071.1270000             -3.47097070D-03   
  9   8760.5591000             -8.71479320D-03   
 10   4033.8159000             -1.94788765D-02   
 11   1936.6618000             -3.80537849D-02   
 12    959.8958000             -5.56062621D-02   
 13    487.1595800             -3.51810242D-02   
 14    251.5140500              1.13010231D-01   
 15    131.4338200              3.57761671D-01   
 16     69.2566110              2.74530035D-01   
 17     36.6964560             -6.58869813D-01   
 18     19.5139200             -9.71765022D-01   
 19     10.4000870              3.25562434D-01   
 20      5.5502436              9.60413128D-01   
 21      2.9642867              2.89323694D-01   
 22      1.5838295              9.94349890D-03   
 23      0.84642317             5.09550318D-03   
 24      0.45238567            -1.65255934D-03   
 25      0.24179521             1.24607258D-03   
 26      0.12923879            -7.28402783D-04   
 27      0.69078028E-01         3.94875069D-04   
 28      0.36922185E-01        -1.65557414D-04   
 29      0.19734899E-01         3.88704977D-05   
S   29
  1 96293620.0000000           -8.70379119D-08   
  2 19555636.0000000           -4.87868677D-07   
  3 4607673.0000000            -2.77107571D-06   
  4 1245720.3000000            -1.27612575D-05   
  5 381541.5300000             -5.08105438D-05   
  6 130537.1300000             -1.75185216D-04   
  7  49154.8270000             -5.39627910D-04   
  8  20071.1270000             -1.48448706D-03   
  9   8760.5591000             -3.73685635D-03   
 10   4033.8159000             -8.33608578D-03   
 11   1936.6618000             -1.63793665D-02   
 12    959.8958000             -2.38597329D-02   
 13    487.1595800             -1.55026806D-02   
 14    251.5140500              5.02220165D-02   
 15    131.4338200              1.59003333D-01   
 16     69.2566110              1.30891493D-01   
 17     36.6964560             -3.40095700D-01   
 18     19.5139200             -5.17079838D-01   
 19     10.4000870              1.99231706D-01   
 20      5.5502436              9.73223477D-01   
 21      2.9642867              3.62668534D-01   
 22      1.5838295             -7.10455627D-01   
 23      0.84642317            -6.49050045D-01   
 24      0.45238567            -1.91121327D-01   
 25      0.24179521             2.51296011D-04   
 26      0.12923879            -8.01521962D-03   
 27      0.69078028E-01         4.30429084D-03   
 28      0.36922185E-01        -1.87098138D-03   
 29      0.19734899E-01         4.50059972D-04   
S   29
  1 96293620.0000000           -2.22422106D-08   
  2 19555636.0000000           -1.24658653D-07   
  3 4607673.0000000            -7.08157498D-07   
  4 1245720.3000000            -3.26066131D-06   
  5 381541.5300000             -1.29851938D-05   
  6 130537.1300000             -4.47605926D-05   
  7  49154.8270000             -1.37918371D-04   
  8  20071.1270000             -3.79281744D-04   
  9   8760.5591000             -9.55269688D-04   
 10   4033.8159000             -2.12999879D-03   
 11   1936.6618000             -4.19003026D-03   
 12    959.8958000             -6.09852029D-03   
 13    487.1595800             -3.98378669D-03   
 14    251.5140500              1.29216094D-02   
 15    131.4338200              4.08769011D-02   
 16     69.2566110              3.40869005D-02   
 17     36.6964560             -8.97434613D-02   
 18     19.5139200             -1.36943621D-01   
 19     10.4000870              5.27237683D-02   
 20      5.5502436              2.93886642D-01   
 21      2.9642867              1.04856421D-01   
 22      1.5838295             -2.72749121D-01   
 23      0.84642317            -3.17839638D-01   
 24      0.45238567            -1.83783621D-01   
 25      0.24179521             9.17936646D-02   
 26      0.12923879             3.45258336D-01   
 27      0.69078028E-01         4.83350942D-01   
 28      0.36922185E-01         2.72892746D-01   
 29      0.19734899E-01         3.83277672D-02   
P   21
  1 381541.5300000              9.53372056D-06   
  2 130537.1300000              4.42039214D-05   
  3  49154.8270000              2.34150824D-04   
  4  20071.1270000              1.00899829D-03   
  5   8760.5591000              3.90091340D-03   
  6   4033.8159000              1.34163369D-02   
  7   1936.6618000              4.09910803D-02   
  8    959.8958000              1.08307375D-01   
  9    487.1595800              2.30691016D-01   
 10    251.5140500              3.52220724D-01   
 11    131.4338200              3.05582974D-01   
 12     69.2566110              1.08407586D-01   
 13     36.6964560              8.85748399D-03   
 14     19.5139200              4.52300744D-04   
 15     10.4000870             -3.34310920D-04   
 16      5.5502436              1.10327243D-04   
 17      2.9642867             -9.20012192D-05   
 18      1.5838295              6.19359944D-05   
 19      0.84642317            -3.09418142D-05   
 20      0.45238567             1.51952378D-05   
 21      0.24179521            -3.71404130D-06   
P   21
  1 381541.5300000             -4.81038380D-06   
  2 130537.1300000             -2.22043039D-05   
  3  49154.8270000             -1.18304981D-04   
  4  20071.1270000             -5.08988503D-04   
  5   8760.5591000             -1.98439423D-03   
  6   4033.8159000             -6.87586779D-03   
  7   1936.6618000             -2.14936211D-02   
  8    959.8958000             -5.87970639D-02   
  9    487.1595800             -1.32989764D-01   
 10    251.5140500             -2.16945392D-01   
 11    131.4338200             -1.57152874D-01   
 12     69.2566110              2.16778131D-01   
 13     36.6964560              5.63954511D-01   
 14     19.5139200              3.28588472D-01   
 15     10.4000870              4.88715132D-02   
 16      5.5502436              3.89962949D-03   
 17      2.9642867             -9.21272894D-04   
 18      1.5838295              6.09955911D-04   
 19      0.84642317            -4.31529251D-04   
 20      0.45238567             1.74913392D-04   
 21      0.24179521            -4.99681774D-05   
P   21
  1 381541.5300000              2.37760865D-06   
  2 130537.1300000              1.09864369D-05   
  3  49154.8270000              5.84942100D-05   
  4  20071.1270000              2.51995606D-04   
  5   8760.5591000              9.82977612D-04   
  6   4033.8159000              3.41622527D-03   
  7   1936.6618000              1.07251576D-02   
  8    959.8958000              2.96150088D-02   
  9    487.1595800              6.79212943D-02   
 10    251.5140500              1.13048727D-01   
 11    131.4338200              7.60759104D-02   
 12     69.2566110             -1.72405490D-01   
 13     36.6964560             -4.72769969D-01   
 14     19.5139200             -1.59297314D-01   
 15     10.4000870              5.12786277D-01   
 16      5.5502436              5.66926482D-01   
 17      2.9642867              1.50135905D-01   
 18      1.5838295              1.17361120D-02   
 19      0.84642317             2.57774118D-04   
 20      0.45238567             5.62835847D-04   
 21      0.24179521            -1.23714429D-04   
P   21
  1 381541.5300000              9.52830730D-07   
  2 130537.1300000              4.40491808D-06   
  3  49154.8270000              2.34435097D-05   
  4  20071.1270000              1.01044698D-04   
  5   8760.5591000              3.94135100D-04   
  6   4033.8159000              1.37087019D-03   
  7   1936.6618000              4.30744867D-03   
  8    959.8958000              1.19198945D-02   
  9    487.1595800              2.74215729D-02   
 10    251.5140500              4.58503450D-02   
 11    131.4338200              3.03114686D-02   
 12     69.2566110             -7.62016351D-02   
 13     36.6964560             -2.13205300D-01   
 14     19.5139200             -5.31850858D-02   
 15     10.4000870              3.14057732D-01   
 16      5.5502436              4.22649595D-01   
 17      2.9642867             -8.47702167D-02   
 18      1.5838295             -5.21453417D-01   
 19      0.84642317            -4.45172176D-01   
 20      0.45238567            -1.49807246D-01   
 21      0.24179521            -2.61518881D-02   
D   19
  1  20071.1270000              1.69660633D-05   
  2   8760.5591000              7.15155337D-05   
  3   4033.8159000              4.14271925D-04   
  4   1936.6618000              1.86173875D-03   
  5    959.8958000              7.94087891D-03   
  6    487.1595800              2.87523814D-02   
  7    251.5140500              8.85042132D-02   
  8    131.4338200              2.10388711D-01   
  9     69.2566110              3.52094121D-01   
 10     36.6964560              3.44917389D-01   
 11     19.5139200              1.50155888D-01   
 12     10.4000870              2.39541554D-02   
 13      5.5502436              1.30293858D-03   
 14      2.9642867              2.80280058D-04   
 15      1.5838295             -6.97013386D-05   
 16      0.84642317             4.92325045D-05   
 17      0.45238567            -3.05132024D-05   
 18      0.24179521             1.43096195D-05   
 19      0.12923879            -4.11344214D-06   
D   19
  1  20071.1270000             -8.89734806D-06   
  2   8760.5591000             -3.60828721D-05   
  3   4033.8159000             -2.16600833D-04   
  4   1936.6618000             -9.56342680D-04   
  5    959.8958000             -4.16147993D-03   
  6    487.1595800             -1.50780447D-02   
  7    251.5140500             -4.75738773D-02   
  8    131.4338200             -1.14558426D-01   
  9     69.2566110             -1.89299538D-01   
 10     36.6964560             -1.31304228D-01   
 11     19.5139200              1.73861721D-01   
 12     10.4000870              4.46968692D-01   
 13      5.5502436              3.87096331D-01   
 14      2.9642867              1.29440721D-01   
 15      1.5838295              1.72554156D-02   
 16      0.84642317             3.71840464D-04   
 17      0.45238567             5.16949874D-04   
 18      0.24179521            -2.17829301D-04   
 19      0.12923879             6.50710564D-05   
D   19
  1  20071.1270000              2.86875784D-06   
  2   8760.5591000              1.12975148D-05   
  3   4033.8159000              6.95905383D-05   
  4   1936.6618000              3.02709674D-04   
  5    959.8958000              1.33223572D-03   
  6    487.1595800              4.80333588D-03   
  7    251.5140500              1.52817051D-02   
  8    131.4338200              3.67601659D-02   
  9     69.2566110              6.08877855D-02   
 10     36.6964560              3.75229907D-02   
 11     19.5139200             -7.61502854D-02   
 12     10.4000870             -1.78490725D-01   
 13      5.5502436             -1.39270302D-01   
 14      2.9642867              1.07222165D-01   
 15      1.5838295              3.26994971D-01   
 16      0.84642317             3.58882295D-01   
 17      0.45238567             2.68293847D-01   
 18      0.24179521             1.24206834D-01   
 19      0.12923879             4.36812143D-02   
F   13
  1   1936.6618000              3.56791119D-05   
  2    959.8958000              1.46966278D-04   
  3    487.1595800              9.30093424D-04   
  4    251.5140500              4.20692308D-03   
  5    131.4338200              1.78309222D-02   
  6     69.2566110              5.73003881D-02   
  7     36.6964560              1.45812723D-01   
  8     19.5139200              2.62819476D-01   
  9     10.4000870              3.27881642D-01   
 10      5.5502436              2.86337995D-01   
 11      2.9642867              1.59657359D-01   
 12      1.5838295              5.26540240D-02   
 13      0.84642317             1.17324360D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Tl
data:
THALLIUM
S   28
  1      0.10945911E+09         2.26158117D-06   
  2 22248380.0000000            1.27551529D-05   
  3 5181281.8000000             7.40081108D-05   
  4 1370380.7000000             3.53851151D-04   
  5 407442.8400000              1.46778115D-03   
  6 134635.4900000              5.30864235D-03   
  7  48844.3240000              1.69365833D-02   
  8  19211.8640000              4.76211155D-02   
  9   8091.3614000              1.15978741D-01   
 10   3605.9814000              2.31890148D-01   
 11   1682.0961000              3.39537774D-01   
 12    813.4231400              2.88020476D-01   
 13    404.4180000              9.41112282D-02   
 14    205.3091400              5.24169135D-03   
 15    105.8377900              5.32078521D-04   
 16     55.1615910             -2.98777960D-04   
 17     28.9702330              1.11006391D-04   
 18     15.2937230             -8.32520175D-05   
 19      8.1011289              6.27135616D-05   
 20      4.3003763             -3.95960415D-05   
 21      2.2857507              2.86197676D-05   
 22      1.2158331             -2.13059547D-05   
 23      0.64698377             1.52703312D-05   
 24      0.34434999            -1.07815508D-05   
 25      0.18329320             7.07107450D-06   
 26      0.97568223E-01        -4.03305569D-06   
 27      0.51936861E-01         1.75288784D-06   
 28      0.27646766E-01        -4.21347764D-07   
S   28
  1      0.10945911E+09         7.54019715D-07   
  2 22248380.0000000            4.25255990D-06   
  3 5181281.8000000             2.46783569D-05   
  4 1370380.7000000             1.18036494D-04   
  5 407442.8400000              4.90309538D-04   
  6 134635.4900000              1.78012618D-03   
  7  48844.3240000              5.73789858D-03   
  8  19211.8640000              1.65318095D-02   
  9   8091.3614000              4.25310305D-02   
 10   3605.9814000              9.53203015D-02   
 11   1682.0961000              1.74326802D-01   
 12    813.4231400              2.10562409D-01   
 13    404.4180000              2.15388083D-02   
 14    205.3091400             -4.40328785D-01   
 15    105.8377900             -5.54384915D-01   
 16     55.1615910             -1.67345374D-01   
 17     28.9702330             -7.17421349D-03   
 18     15.2937230              2.44268312D-04   
 19      8.1011289             -3.07367963D-04   
 20      4.3003763              5.38444857D-04   
 21      2.2857507             -4.42371950D-04   
 22      1.2158331              3.29265769D-04   
 23      0.64698377            -2.49974792D-04   
 24      0.34434999             1.75220832D-04   
 25      0.18329320            -1.14674483D-04   
 26      0.97568223E-01         6.53968486D-05   
 27      0.51936861E-01        -2.84764065D-05   
 28      0.27646766E-01         6.87635375D-06   
S   28
  1      0.10945911E+09         3.58374233D-07   
  2 22248380.0000000            2.02218892D-06   
  3 5181281.8000000             1.17282599D-05   
  4 1370380.7000000             5.61367725D-05   
  5 407442.8400000              2.33060248D-04   
  6 134635.4900000              8.47397785D-04   
  7  48844.3240000              2.73285655D-03   
  8  19211.8640000              7.91400362D-03   
  9   8091.3614000              2.05008622D-02   
 10   3605.9814000              4.68916644D-02   
 11   1682.0961000              8.87168328D-02   
 12    813.4231400              1.15463745D-01   
 13    404.4180000              1.06143341D-02   
 14    205.3091400             -3.58478393D-01   
 15    105.8377900             -6.63726195D-01   
 16     55.1615910              1.17615024D-02   
 17     28.9702330              8.87282686D-01   
 18     15.2937230              4.06949740D-01   
 19      8.1011289              3.68910286D-02   
 20      4.3003763             -5.19133972D-04   
 21      2.2857507              1.86010522D-03   
 22      1.2158331             -1.82882663D-03   
 23      0.64698377             1.27177890D-03   
 24      0.34434999            -9.21219348D-04   
 25      0.18329320             5.93658838D-04   
 26      0.97568223E-01        -3.32293853D-04   
 27      0.51936861E-01         1.42473540D-04   
 28      0.27646766E-01        -3.38973999D-05   
S   28
  1      0.10945911E+09        -1.79233222D-07   
  2 22248380.0000000           -1.01152441D-06   
  3 5181281.8000000            -5.86545961D-06   
  4 1370380.7000000            -2.80814065D-05   
  5 407442.8400000             -1.16560844D-04   
  6 134635.4900000             -4.23996545D-04   
  7  48844.3240000             -1.36742836D-03   
  8  19211.8640000             -3.96528428D-03   
  9   8091.3614000             -1.02875472D-02   
 10   3605.9814000             -2.36527315D-02   
 11   1682.0961000             -4.51118586D-02   
 12    813.4231400             -5.98507818D-02   
 13    404.4180000             -5.45513782D-03   
 14    205.3091400              2.04869628D-01   
 15    105.8377900              4.21386508D-01   
 16     55.1615910             -2.20381669D-02   
 17     28.9702330             -1.02890630D+00   
 18     15.2937230             -5.21230939D-01   
 19      8.1011289              8.46060054D-01   
 20      4.3003763              7.12819151D-01   
 21      2.2857507              6.31286262D-02   
 22      1.2158331              2.05795820D-02   
 23      0.64698377            -1.10400865D-02   
 24      0.34434999             8.27507712D-03   
 25      0.18329320            -5.26701553D-03   
 26      0.97568223E-01         2.94883953D-03   
 27      0.51936861E-01        -1.26709858D-03   
 28      0.27646766E-01         3.01453110D-04   
S   28
  1      0.10945911E+09        -7.78429292D-08   
  2 22248380.0000000           -4.39560726D-07   
  3 5181281.8000000            -2.54713031D-06   
  4 1370380.7000000            -1.22036667D-05   
  5 407442.8400000             -5.06134565D-05   
  6 134635.4900000             -1.84295757D-04   
  7  48844.3240000             -5.93725942D-04   
  8  19211.8640000             -1.72458810D-03   
  9   8091.3614000             -4.46821698D-03   
 10   3605.9814000             -1.03094754D-02   
 11   1682.0961000             -1.96361235D-02   
 12    813.4231400             -2.63320608D-02   
 13    404.4180000             -2.11244762D-03   
 14    205.3091400              9.12240058D-02   
 15    105.8377900              1.95802229D-01   
 16     55.1615910             -1.52390068D-02   
 17     28.9702330             -5.41626733D-01   
 18     15.2937230             -3.05010345D-01   
 19      8.1011289              6.62036558D-01   
 20      4.3003763              9.31745229D-01   
 21      2.2857507             -2.83765417D-01   
 22      1.2158331             -8.24759592D-01   
 23      0.64698377            -4.10620496D-01   
 24      0.34434999            -2.90557477D-02   
 25      0.18329320            -1.02383232D-02   
 26      0.97568223E-01         5.07417216D-03   
 27      0.51936861E-01        -2.30870156D-03   
 28      0.27646766E-01         5.48601254D-04   
S   28
  1      0.10945911E+09         2.23252557D-08   
  2 22248380.0000000            1.26094321D-07   
  3 5181281.8000000             7.30477944D-07   
  4 1370380.7000000             3.50088940D-06   
  5 407442.8400000              1.45146176D-05   
  6 134635.4900000              5.28727729D-05   
  7  48844.3240000              1.70254895D-04   
  8  19211.8640000              4.94853043D-04   
  9   8091.3614000              1.28124573D-03   
 10   3605.9814000              2.95975531D-03   
 11   1682.0961000              5.63131952D-03   
 12    813.4231400              7.57736356D-03   
 13    404.4180000              5.73022808D-04   
 14    205.3091400             -2.62329012D-02   
 15    105.8377900             -5.69480011D-02   
 16     55.1615910              4.95645162D-03   
 17     28.9702330              1.60115241D-01   
 18     15.2937230              9.41274281D-02   
 19      8.1011289             -2.14542428D-01   
 20      4.3003763             -3.26058361D-01   
 21      2.2857507              1.32576756D-01   
 22      1.2158331              3.90186758D-01   
 23      0.64698377             3.37144262D-01   
 24      0.34434999             1.45650910D-03   
 25      0.18329320            -3.59317080D-01   
 26      0.97568223E-01        -5.25058643D-01   
 27      0.51936861E-01        -3.01304776D-01   
 28      0.27646766E-01        -4.88002089D-02   
P   24
  1 134635.4900000              6.04689858D-05   
  2  48844.3240000              2.39205807D-04   
  3  19211.8640000              1.20618777D-03   
  4   8091.3614000              4.84145478D-03   
  5   3605.9814000              1.74978080D-02   
  6   1682.0961000              5.47324595D-02   
  7    813.4231400              1.42993838D-01   
  8    404.4180000              2.86148563D-01   
  9    205.3091400              3.73440260D-01   
 10    105.8377900              2.40181565D-01   
 11     55.1615910              5.05463285D-02   
 12     28.9702330              2.08609062D-03   
 13     15.2937230             -3.12066836D-04   
 14      8.1011289              1.63583704D-04   
 15      4.3003763             -2.14070575D-04   
 16      2.2857507              1.61238518D-04   
 17      1.2158331             -1.11935971D-04   
 18      0.64698377             8.32184203D-05   
 19      0.34434999            -5.71131486D-05   
 20      0.18329320             3.86840183D-05   
 21      0.97568223E-01        -2.46279524D-05   
 22      0.51936861E-01         1.40094722D-05   
 23      0.27646766E-01        -6.32440795D-06   
 24      0.14716794E-01         1.65966106D-06   
P   24
  1 134635.4900000              3.04316040D-05   
  2  48844.3240000              1.21243335D-04   
  3  19211.8640000              6.09095086D-04   
  4   8091.3614000              2.47172087D-03   
  5   3605.9814000              9.00196469D-03   
  6   1682.0961000              2.89725914D-02   
  7    813.4231400              7.88030702D-02   
  8    404.4180000              1.69305254D-01   
  9    205.3091400              2.31092577D-01   
 10    105.8377900              5.36369148D-02   
 11     55.1615910             -4.13845887D-01   
 12     28.9702330             -5.36373437D-01   
 13     15.2937230             -1.71252414D-01   
 14      8.1011289             -1.70208913D-02   
 15      4.3003763              1.66808440D-03   
 16      2.2857507             -1.80303511D-03   
 17      1.2158331              1.48318489D-03   
 18      0.64698377            -1.02819208D-03   
 19      0.34434999             7.43526194D-04   
 20      0.18329320            -5.04394648D-04   
 21      0.97568223E-01         3.22944056D-04   
 22      0.51936861E-01        -1.84637953D-04   
 23      0.27646766E-01         8.34560487D-05   
 24      0.14716794E-01        -2.19386966D-05   
P   24
  1 134635.4900000              1.50606516D-05   
  2  48844.3240000              6.05151519D-05   
  3  19211.8640000              3.01600652D-04   
  4   8091.3614000              1.23424796D-03   
  5   3605.9814000              4.48066156D-03   
  6   1682.0961000              1.45849252D-02   
  7    813.4231400              3.98841659D-02   
  8    404.4180000              8.76997562D-02   
  9    205.3091400              1.20343815D-01   
 10    105.8377900              1.20269985D-02   
 11     55.1615910             -3.30759548D-01   
 12     28.9702330             -4.48209312D-01   
 13     15.2937230              1.58980596D-01   
 14      8.1011289              6.53667328D-01   
 15      4.3003763              3.76210129D-01   
 16      2.2857507              4.11843248D-02   
 17      1.2158331              8.96947100D-03   
 18      0.64698377            -4.19200033D-03   
 19      0.34434999             3.29735270D-03   
 20      0.18329320            -2.26167880D-03   
 21      0.97568223E-01         1.45199379D-03   
 22      0.51936861E-01        -8.40926020D-04   
 23      0.27646766E-01         3.81253418D-04   
 24      0.14716794E-01        -1.00673024D-04   
P   24
  1 134635.4900000             -6.13258277D-06   
  2  48844.3240000             -2.48859535D-05   
  3  19211.8640000             -1.22784024D-04   
  4   8091.3614000             -5.06875807D-04   
  5   3605.9814000             -1.82798074D-03   
  6   1682.0961000             -5.99666442D-03   
  7    813.4231400             -1.63370599D-02   
  8    404.4180000             -3.63106799D-02   
  9    205.3091400             -4.94724663D-02   
 10    105.8377900             -4.02639021D-03   
 11     55.1615910              1.51723689D-01   
 12     28.9702330              2.01487161D-01   
 13     15.2937230             -1.11092979D-01   
 14      8.1011289             -4.50120577D-01   
 15      4.3003763             -2.53163416D-01   
 16      2.2857507              3.84391001D-01   
 17      1.2158331              5.47577021D-01   
 18      0.64698377             2.91820126D-01   
 19      0.34434999             4.55238338D-02   
 20      0.18329320             9.35256510D-03   
 21      0.97568223E-01        -2.62134054D-03   
 22      0.51936861E-01         2.13202133D-03   
 23      0.27646766E-01        -9.08856621D-04   
 24      0.14716794E-01         2.56108940D-04   
P   24
  1 134635.4900000              1.31049676D-06   
  2  48844.3240000              5.33041101D-06   
  3  19211.8640000              2.62364247D-05   
  4   8091.3614000              1.08530042D-04   
  5   3605.9814000              3.90762472D-04   
  6   1682.0961000              1.28408647D-03   
  7    813.4231400              3.49439516D-03   
  8    404.4180000              7.78328279D-03   
  9    205.3091400              1.05834875D-02   
 10    105.8377900              8.49593358D-04   
 11     55.1615910             -3.30093074D-02   
 12     28.9702330             -4.35664940D-02   
 13     15.2937230              2.51505311D-02   
 14      8.1011289              1.04328028D-01   
 15      4.3003763              5.62081111D-02   
 16      2.2857507             -1.10548734D-01   
 17      1.2158331             -1.61451096D-01   
 18      0.64698377            -1.04005064D-01   
 19      0.34434999             4.42586123D-02   
 20      0.18329320             2.24097203D-01   
 21      0.97568223E-01         3.70712148D-01   
 22      0.51936861E-01         3.52226683D-01   
 23      0.27646766E-01         1.55338839D-01   
 24      0.14716794E-01         1.67488989D-02   
D   18
  1  19211.8640000              1.99383638D-05   
  2   8091.3614000              9.69836848D-05   
  3   3605.9814000              5.79186102D-04   
  4   1682.0961000              2.78062011D-03   
  5    813.4231400              1.20908694D-02   
  6    404.4180000              4.37008724D-02   
  7    205.3091400              1.28352557D-01   
  8    105.8377900              2.75500422D-01   
  9     55.1615910              3.85579801D-01   
 10     28.9702330              2.76386180D-01   
 11     15.2937230              7.68891176D-02   
 12      8.1011289              8.02755582D-03   
 13      4.3003763             -1.84801091D-04   
 14      2.2857507              5.31260373D-04   
 15      1.2158331             -3.33606593D-04   
 16      0.64698377             2.00265556D-04   
 17      0.34434999            -9.81485276D-05   
 18      0.18329320             2.86428086D-05   
D   18
  1  19211.8640000             -1.05351414D-05   
  2   8091.3614000             -4.93533464D-05   
  3   3605.9814000             -3.04634924D-04   
  4   1682.0961000             -1.44098515D-03   
  5    813.4231400             -6.39028034D-03   
  6    404.4180000             -2.31856210D-02   
  7    205.3091400             -7.00338605D-02   
  8    105.8377900             -1.51039723D-01   
  9     55.1615910             -1.99468914D-01   
 10     28.9702330             -2.49476120D-02   
 11     15.2937230              3.29318971D-01   
 12      8.1011289              4.73277222D-01   
 13      4.3003763              2.65805308D-01   
 14      2.2857507              5.11400122D-02   
 15      1.2158331              5.78561722D-03   
 16      0.64698377            -8.82898520D-04   
 17      0.34434999             5.78862203D-04   
 18      0.18329320            -1.79619458D-04   
D   18
  1  19211.8640000              3.57871724D-06   
  2   8091.3614000              1.62648935D-05   
  3   3605.9814000              1.02942531D-04   
  4   1682.0961000              4.80156545D-04   
  5    813.4231400              2.15278446D-03   
  6    404.4180000              7.77863716D-03   
  7    205.3091400              2.37090288D-02   
  8    105.8377900              5.09929526D-02   
  9     55.1615910              6.69131394D-02   
 10     28.9702330             -3.37209346D-03   
 11     15.2937230             -1.41192371D-01   
 12      8.1011289             -2.00584364D-01   
 13      4.3003763             -4.05353619D-02   
 14      2.2857507              2.59553596D-01   
 15      1.2158331              3.83479497D-01   
 16      0.64698377             3.34475010D-01   
 17      0.34434999             1.60324626D-01   
 18      0.18329320             6.12928097D-02   
F   12
  1   1682.0961000              5.45328958D-05   
  2    813.4231400              2.75052742D-04   
  3    404.4180000              1.59955910D-03   
  4    205.3091400              7.60578304D-03   
  5    105.8377900              2.99636298D-02   
  6     55.1615910              8.99640164D-02   
  7     28.9702330              2.02638792D-01   
  8     15.2937230              3.10237905D-01   
  9      8.1011289              3.28010913D-01   
 10      4.3003763              2.31376176D-01   
 11      2.2857507              9.27865781D-02   
 12      1.2158331              2.67116280D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Pb
data:
LEAD
S   28
  1 73753376.0000000            3.82918923D-06   
  2 14954702.0000000            2.15654895D-05   
  3 3513435.8000000             1.22783051D-04   
  4 946395.2700000              5.69041300D-04   
  5 288721.3300000              2.26620782D-03   
  6  98410.3170000              7.80972446D-03   
  7  36939.1350000              2.35887702D-02   
  8  15047.3120000              6.23689410D-02   
  9   6558.3089000              1.41406779D-01   
 10   3018.2805000              2.59105582D-01   
 11   1449.6318000              3.38039531D-01   
 12    719.2957500              2.44808363D-01   
 13    365.6662000              6.38439352D-02   
 14    189.1857500              2.87346245D-03   
 15     99.0986130              2.90868108D-05   
 16     52.3514000              6.48129547D-05   
 17     27.8120670             -1.61469532D-04   
 18     14.8288060              1.27096139D-04   
 19      7.9240379             -9.35114280D-05   
 20      4.2399181              7.52443781D-05   
 21      2.2703218             -5.56834928D-05   
 22      1.2161428              3.97734004D-05   
 23      0.65157228            -2.81510121D-05   
 24      0.34912095             1.89908749D-05   
 25      0.18706936            -1.19341206D-05   
 26      0.10023829             6.55603564D-06   
 27      0.53711299E-01        -2.76098836D-06   
 28      0.28780466E-01         6.48049619D-07   
S   28
  1 73753376.0000000            1.27740430D-06   
  2 14954702.0000000            7.19485223D-06   
  3 3513435.8000000             4.09684215D-05   
  4 946395.2700000              1.90000553D-04   
  5 288721.3300000              7.58077278D-04   
  6  98410.3170000              2.62679314D-03   
  7  36939.1350000              8.04098351D-03   
  8  15047.3120000              2.19385296D-02   
  9   6558.3089000              5.31742688D-02   
 10   3018.2805000              1.11544412D-01   
 11   1449.6318000              1.86782319D-01   
 12    719.2957500              1.92213121D-01   
 13    365.6662000             -4.99975504D-02   
 14    189.1857500             -4.92936469D-01   
 15     99.0986130             -5.03741914D-01   
 16     52.3514000             -1.25968405D-01   
 17     27.8120670             -4.98994824D-03   
 18     14.8288060              7.76110956D-04   
 19      7.9240379             -6.07714939D-04   
 20      4.2399181              7.05442501D-04   
 21      2.2703218             -5.53820043D-04   
 22      1.2161428              3.98690109D-04   
 23      0.65157228            -2.91111278D-04   
 24      0.34912095             1.97880635D-04   
 25      0.18706936            -1.25094352D-04   
 26      0.10023829             6.90226791D-05   
 27      0.53711299E-01        -2.91277572D-05   
 28      0.28780466E-01         6.84928263D-06   
S   28
  1 73753376.0000000            6.07958961D-07   
  2 14954702.0000000            3.42591475D-06   
  3 3513435.8000000             1.94967090D-05   
  4 946395.2700000              9.04885327D-05   
  5 288721.3300000              3.60867869D-04   
  6  98410.3170000              1.25263696D-03   
  7  36939.1350000              3.83805542D-03   
  8  15047.3120000              1.05382529D-02   
  9   6558.3089000              2.57614517D-02   
 10   3018.2805000              5.53756606D-02   
 11   1449.6318000              9.63679044D-02   
 12    719.2957500              1.07889687D-01   
 13    365.6662000             -3.62894493D-02   
 14    189.1857500             -4.24198143D-01   
 15     99.0986130             -6.33416574D-01   
 16     52.3514000              1.56615363D-01   
 17     27.8120670              8.82204327D-01   
 18     14.8288060              3.37668966D-01   
 19      7.9240379              3.24037971D-02   
 20      4.2399181             -4.08041825D-03   
 21      2.2703218              4.20600241D-03   
 22      1.2161428             -3.56017608D-03   
 23      0.65157228             2.51109778D-03   
 24      0.34912095            -1.76090465D-03   
 25      0.18706936             1.12564004D-03   
 26      0.10023829            -6.23773265D-04   
 27      0.53711299E-01         2.64820084D-04   
 28      0.28780466E-01        -6.23558413D-05   
S   28
  1 73753376.0000000           -3.05101207D-07   
  2 14954702.0000000           -1.71993388D-06   
  3 3513435.8000000            -9.78353386D-06   
  4 946395.2700000             -4.54324658D-05   
  5 288721.3300000             -1.81086271D-04   
  6  98410.3170000             -6.29178601D-04   
  7  36939.1350000             -1.92697673D-03   
  8  15047.3120000             -5.30358186D-03   
  9   6558.3089000             -1.29777519D-02   
 10   3018.2805000             -2.81064399D-02   
 11   1449.6318000             -4.92670902D-02   
 12    719.2957500             -5.66212047D-02   
 13    365.6662000              2.04285558D-02   
 14    189.1857500              2.45788941D-01   
 15     99.0986130              4.14017189D-01   
 16     52.3514000             -1.47202388D-01   
 17     27.8120670             -1.06839463D+00   
 18     14.8288060             -3.78521390D-01   
 19      7.9240379              9.04178821D-01   
 20      4.2399181              6.44867603D-01   
 21      2.2703218              4.42983397D-02   
 22      1.2161428              2.10680545D-02   
 23      0.65157228            -1.16705841D-02   
 24      0.34912095             8.51316538D-03   
 25      0.18706936            -5.42025276D-03   
 26      0.10023829             3.00407532D-03   
 27      0.53711299E-01        -1.28375345D-03   
 28      0.28780466E-01         3.02690022D-04   
S   28
  1 73753376.0000000           -1.34464934D-07   
  2 14954702.0000000           -7.58529358D-07   
  3 3513435.8000000            -4.31114082D-06   
  4 946395.2700000             -2.00389103D-05   
  5 288721.3300000             -7.97852157D-05   
  6  98410.3170000             -2.77595118D-04   
  7  36939.1350000             -8.48872209D-04   
  8  15047.3120000             -2.34203142D-03   
  9   6558.3089000             -5.71826165D-03   
 10   3018.2805000             -1.24486111D-02   
 11   1449.6318000             -2.17486611D-02   
 12    719.2957500             -2.54139150D-02   
 13    365.6662000              9.70167121D-03   
 14    189.1857500              1.11151647D-01   
 15     99.0986130              1.97554300D-01   
 16     52.3514000             -8.06449075D-02   
 17     27.8120670             -5.73478978D-01   
 18     14.8288060             -2.34834439D-01   
 19      7.9240379              7.60073302D-01   
 20      4.2399181              8.86143867D-01   
 21      2.2703218             -3.94051282D-01   
 22      1.2161428             -8.27118562D-01   
 23      0.65157228            -3.62238256D-01   
 24      0.34912095            -1.08921372D-02   
 25      0.18706936            -1.27112566D-02   
 26      0.10023829             6.53983622D-03   
 27      0.53711299E-01        -2.96989924D-03   
 28      0.28780466E-01         6.99455932D-04   
S   28
  1 73753376.0000000           -4.16070192D-08   
  2 14954702.0000000           -2.34773152D-07   
  3 3513435.8000000            -1.33389619D-06   
  4 946395.2700000             -6.20252260D-06   
  5 288721.3300000             -2.46846032D-05   
  6  98410.3170000             -8.59314104D-05   
  7  36939.1350000             -2.62603950D-04   
  8  15047.3120000             -7.25184726D-04   
  9   6558.3089000             -1.76879266D-03   
 10   3018.2805000             -3.85756871D-03   
 11   1449.6318000             -6.72681659D-03   
 12    719.2957500             -7.90449102D-03   
 13    365.6662000              3.07667213D-03   
 14    189.1857500              3.44809861D-02   
 15     99.0986130              6.22184093D-02   
 16     52.3514000             -2.63621163D-02   
 17     27.8120670             -1.83132605D-01   
 18     14.8288060             -8.03104388D-02   
 19      7.9240379              2.71534910D-01   
 20      4.2399181              3.35964919D-01   
 21      2.2703218             -1.90164152D-01   
 22      1.2161428             -4.49442634D-01   
 23      0.65157228            -3.63610539D-01   
 24      0.34912095             9.69396805D-02   
 25      0.18706936             4.61911298D-01   
 26      0.10023829             5.17141522D-01   
 27      0.53711299E-01         2.08273349D-01   
 28      0.28780466E-01         1.94030561D-02   
P   24
  1 288721.3300000              1.70058202D-05   
  2  98410.3170000              7.92965485D-05   
  3  36939.1350000              4.22217793D-04   
  4  15047.3120000              1.81114656D-03   
  5   6558.3089000              6.94636866D-03   
  6   3018.2805000              2.32823956D-02   
  7   1449.6318000              6.81652212D-02   
  8    719.2957500              1.65262691D-01   
  9    365.6662000              3.05021173D-01   
 10    189.1857500              3.59837420D-01   
 11     99.0986130              2.04821449D-01   
 12     52.3514000              3.67769133D-02   
 13     27.8120670              1.43534510D-03   
 14     14.8288060             -3.70506926D-04   
 15      7.9240379              1.80173576D-04   
 16      4.2399181             -2.06551098D-04   
 17      2.2703218              1.55027759D-04   
 18      1.2161428             -1.05246435D-04   
 19      0.65157228             7.69706035D-05   
 20      0.34912095            -5.13968785D-05   
 21      0.18706936             3.28830095D-05   
 22      0.10023829            -1.87147050D-05   
 23      0.53711299E-01         8.40316368D-06   
 24      0.28780466E-01        -2.19369890D-06   
P   24
  1 288721.3300000              8.61496518D-06   
  2  98410.3170000              3.99537288D-05   
  3  36939.1350000              2.14300250D-04   
  4  15047.3120000              9.17842020D-04   
  5   6558.3089000              3.56010681D-03   
  6   3018.2805000              1.20616835D-02   
  7   1449.6318000              3.64455028D-02   
  8    719.2957500              9.23759716D-02   
  9    365.6662000              1.83401905D-01   
 10    189.1857500              2.20514789D-01   
 11     99.0986130             -1.46055730D-03   
 12     52.3514000             -4.57894039D-01   
 13     27.8120670             -4.99546432D-01   
 14     14.8288060             -1.40740919D-01   
 15      7.9240379             -1.37368622D-02   
 16      4.2399181              1.97899036D-03   
 17      2.2703218             -1.86298922D-03   
 18      1.2161428              1.51932918D-03   
 19      0.65157228            -1.03963342D-03   
 20      0.34912095             7.27727557D-04   
 21      0.18706936            -4.67886661D-04   
 22      0.10023829             2.67392786D-04   
 23      0.53711299E-01        -1.20827366D-04   
 24      0.28780466E-01         3.15376359D-05   
P   24
  1 288721.3300000              4.31541071D-06   
  2  98410.3170000              1.98147065D-05   
  3  36939.1350000              1.07383575D-04   
  4  15047.3120000              4.56536999D-04   
  5   6558.3089000              1.78629467D-03   
  6   3018.2805000              6.03540974D-03   
  7   1449.6318000              1.84656022D-02   
  8    719.2957500              4.70838881D-02   
  9    365.6662000              9.58529902D-02   
 10    189.1857500              1.14712173D-01   
 11     99.0986130             -2.34625692D-02   
 12     52.3514000             -3.72107717D-01   
 13     27.8120670             -4.09391144D-01   
 14     14.8288060              2.30518995D-01   
 15      7.9240379              6.55157922D-01   
 16      4.2399181              3.33462754D-01   
 17      2.2703218              3.25831987D-02   
 18      1.2161428              7.56827173D-03   
 19      0.65157228            -3.47063153D-03   
 20      0.34912095             2.61242804D-03   
 21      0.18706936            -1.70529976D-03   
 22      0.10023829             9.71143912D-04   
 23      0.53711299E-01        -4.45248206D-04   
 24      0.28780466E-01         1.16284238D-04   
P   24
  1 288721.3300000              1.80824555D-06   
  2  98410.3170000              8.20746439D-06   
  3  36939.1350000              4.49938614D-05   
  4  15047.3120000              1.89550059D-04   
  5   6558.3089000              7.47905029D-04   
  6   3018.2805000              2.51124463D-03   
  7   1449.6318000              7.74492768D-03   
  8    719.2957500              1.96757664D-02   
  9    365.6662000              4.05205939D-02   
 10    189.1857500              4.79764328D-02   
 11     99.0986130             -1.15532010D-02   
 12     52.3514000             -1.74876934D-01   
 13     27.8120670             -1.85423605D-01   
 14     14.8288060              1.53839346D-01   
 15      7.9240379              4.74390389D-01   
 16      4.2399181              2.03410874D-01   
 17      2.2703218             -4.33977640D-01   
 18      1.2161428             -5.44339183D-01   
 19      0.65157228            -2.55434380D-01   
 20      0.34912095            -3.06557458D-02   
 21      0.18706936            -7.88218816D-03   
 22      0.10023829             2.29238330D-03   
 23      0.53711299E-01        -1.44895589D-03   
 24      0.28780466E-01         3.46043731D-04   
P   24
  1 288721.3300000              4.49840355D-07   
  2  98410.3170000              2.03607072D-06   
  3  36939.1350000              1.11929667D-05   
  4  15047.3120000              4.70487244D-05   
  5   6558.3089000              1.86010856D-04   
  6   3018.2805000              6.23581378D-04   
  7   1449.6318000              1.92663328D-03   
  8    719.2957500              4.88903296D-03   
  9    365.6662000              1.00925152D-02   
 10    189.1857500              1.19173473D-02   
 11     99.0986130             -2.91937806D-03   
 12     52.3514000             -4.42720757D-02   
 13     27.8120670             -4.65162520D-02   
 14     14.8288060              4.04909711D-02   
 15      7.9240379              1.29158435D-01   
 16      4.2399181              5.00942250D-02   
 17      2.2703218             -1.46579511D-01   
 18      1.2161428             -1.94828063D-01   
 19      0.65157228            -1.11384359D-01   
 20      0.34912095             1.04176258D-01   
 21      0.18706936             3.16411189D-01   
 22      0.10023829             4.15643841D-01   
 23      0.53711299E-01         2.66909860D-01   
 24      0.28780466E-01         7.45744495D-02   
D   18
  1  15047.3120000              3.59416477D-05   
  2   6558.3089000              1.56302743D-04   
  3   3018.2805000              8.68681483D-04   
  4   1449.6318000              3.89171816D-03   
  5    719.2957500              1.57173069D-02   
  6    365.6662000              5.31885995D-02   
  7    189.1857500              1.45889279D-01   
  8     99.0986130              2.92554446D-01   
  9     52.3514000              3.79595544D-01   
 10     27.8120670              2.48299705D-01   
 11     14.8288060              6.32814740D-02   
 12      7.9240379              6.08078379D-03   
 13      4.2399181             -1.17250485D-04   
 14      2.2703218              3.98369929D-04   
 15      1.2161428             -2.54730279D-04   
 16      0.65157228             1.51986407D-04   
 17      0.34912095            -7.39664069D-05   
 18      0.18706936             2.15781949D-05   
D   18
  1  15047.3120000             -1.89203327D-05   
  2   6558.3089000             -8.08815287D-05   
  3   3018.2805000             -4.57737647D-04   
  4   1449.6318000             -2.03971970D-03   
  5    719.2957500             -8.36128132D-03   
  6    365.6662000             -2.85436615D-02   
  7    189.1857500             -8.03416873D-02   
  8     99.0986130             -1.61387561D-01   
  9     52.3514000             -1.91685977D-01   
 10     27.8120670              1.24437822D-02   
 11     14.8288060              3.57215939D-01   
 12      7.9240379              4.63870338D-01   
 13      4.2399181              2.37321536D-01   
 14      2.2703218              4.20741624D-02   
 15      1.2161428              4.27297632D-03   
 16      0.65157228            -6.37568425D-04   
 17      0.34912095             3.96290811D-04   
 18      0.18706936            -1.32821166D-04   
D   18
  1  15047.3120000              6.66967142D-06   
  2   6558.3089000              2.80068266D-05   
  3   3018.2805000              1.61067386D-04   
  4   1449.6318000              7.11330239D-04   
  5    719.2957500              2.93969718D-03   
  6    365.6662000              1.00160902D-02   
  7    189.1857500              2.84131672D-02   
  8     99.0986130              5.69408057D-02   
  9     52.3514000              6.65730107D-02   
 10     27.8120670             -1.92115267D-02   
 11     14.8288060             -1.59721093D-01   
 12      7.9240379             -2.05902467D-01   
 13      4.2399181             -1.03677097D-02   
 14      2.2703218              2.93949597D-01   
 15      1.2161428              4.00084182D-01   
 16      0.65157228             3.13724999D-01   
 17      0.34912095             1.29632613D-01   
 18      0.18706936             3.81662835D-02   
F   12
  1   1449.6318000              8.77099956D-05   
  2    719.2957500              3.97412809D-04   
  3    365.6662000              2.15620333D-03   
  4    189.1857500              9.69697352D-03   
  5     99.0986130              3.56720551D-02   
  6     52.3514000              1.01804428D-01   
  7     27.8120670              2.17036947D-01   
  8     14.8288060              3.16336216D-01   
  9      7.9240379              3.21083592D-01   
 10      4.2399181              2.12295861D-01   
 11      2.2703218              7.98722378D-02   
 12      1.2161428              1.99406166D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Bi
data:
BISMUTH
S   28
  1 81466050.0000000            3.47871658D-06   
  2 16616094.0000000            1.94151038D-05   
  3 3918843.6000000             1.10202787D-04   
  4 1057867.4000000             5.09854749D-04   
  5 322990.5300000              2.03104690D-03   
  6 110076.8900000              7.01182652D-03   
  7  41290.5020000              2.12570401D-02   
  8  16805.3900000              5.65811360D-02   
  9   7319.0317000              1.29918643D-01   
 10   3366.9167000              2.43900458D-01   
 11   1617.1036000              3.33784818D-01   
 12    802.8171500              2.64839151D-01   
 13    408.5492700              8.19891834D-02   
 14    211.6909000              4.65613584D-03   
 15    111.0992600              3.71492244D-04   
 16     58.8227310             -1.86583954D-04   
 17     31.3281730              3.08941668D-05   
 18     16.7484920             -2.57959861D-05   
 19      8.9751627              2.03670527D-05   
 20      4.8163589             -7.77205693D-06   
 21      2.5866598              4.93062736D-06   
 22      1.3897663             -3.69547358D-06   
 23      0.74684967             2.24567037D-06   
 24      0.40138756            -1.50606464D-06   
 25      0.21572963             9.54000994D-07   
 26      0.11594728            -5.30511618D-07   
 27      0.62317860E-01         2.31279802D-07   
 28      0.33493819E-01        -5.55772711D-08   
S   28
  1 81466050.0000000            1.16121335D-06   
  2 16616094.0000000            6.48101087D-06   
  3 3918843.6000000             3.67937494D-05   
  4 1057867.4000000             1.70319699D-04   
  5 322990.5300000              6.79701566D-04   
  6 110076.8900000              2.35805305D-03   
  7  41290.5020000              7.23817127D-03   
  8  16805.3900000              1.98265163D-02   
  9   7319.0317000              4.84256515D-02   
 10   3366.9167000              1.02966977D-01   
 11   1617.1036000              1.77944811D-01   
 12    802.8171500              2.00052367D-01   
 13    408.5492700             -1.16310508D-04   
 14    211.6909000             -4.41238264D-01   
 15    111.0992600             -5.39952887D-01   
 16     58.8227310             -1.70048836D-01   
 17     31.3281730             -7.80899909D-03   
 18     16.7484920             -2.43147733D-04   
 19      8.9751627              1.04697440D-04   
 20      4.8163589              2.22704244D-04   
 21      2.5866598             -1.97722190D-04   
 22      1.3897663              1.43010922D-04   
 23      0.74684967            -1.13762723D-04   
 24      0.40138756             7.82441085D-05   
 25      0.21572963            -4.98278286D-05   
 26      0.11594728             2.76840456D-05   
 27      0.62317860E-01        -1.16512300D-05   
 28      0.33493819E-01         2.73575046D-06   
S   28
  1 81466050.0000000            5.53405353D-07   
  2 16616094.0000000            3.08998502D-06   
  3 3918843.6000000             1.75338225D-05   
  4 1057867.4000000             8.12182513D-05   
  5 322990.5300000              3.23993656D-04   
  6 110076.8900000              1.12577716D-03   
  7  41290.5020000              3.45881056D-03   
  8  16805.3900000              9.52893255D-03   
  9   7319.0317000              2.34611269D-02   
 10   3366.9167000              5.10096450D-02   
 11   1617.1036000              9.13890971D-02   
 12    802.8171500              1.11011203D-01   
 13    408.5492700             -3.14832862D-03   
 14    211.6909000             -3.64519965D-01   
 15    111.0992600             -6.50360060D-01   
 16     58.8227310             -6.71075864D-03   
 17     31.3281730              8.66430110D-01   
 18     16.7484920              4.36297497D-01   
 19      8.9751627              4.38198074D-02   
 20      4.8163589              6.51553486D-04   
 21      2.5866598              1.00727656D-03   
 22      1.3897663             -1.20142765D-03   
 23      0.74684967             7.95748445D-04   
 24      0.40138756            -5.92069254D-04   
 25      0.21572963             3.85823428D-04   
 26      0.11594728            -2.13958287D-04   
 27      0.62317860E-01         9.15137955D-05   
 28      0.33493819E-01        -2.14876648D-05   
S   28
  1 81466050.0000000           -2.78710629D-07   
  2 16616094.0000000           -1.55648702D-06   
  3 3918843.6000000            -8.83022279D-06   
  4 1057867.4000000            -4.09134543D-05   
  5 322990.5300000             -1.63174368D-04   
  6 110076.8900000             -5.67284964D-04   
  7  41290.5020000             -1.74296999D-03   
  8  16805.3900000             -4.80979293D-03   
  9   7319.0317000             -1.18616140D-02   
 10   3366.9167000             -2.59428940D-02   
 11   1617.1036000             -4.68666775D-02   
 12    802.8171500             -5.81274257D-02   
 13    408.5492700              2.01443031D-03   
 14    211.6909000              2.10502550D-01   
 15    111.0992600              4.17214326D-01   
 16     58.8227310             -7.83950352D-03   
 17     31.3281730             -1.00340392D+00   
 18     16.7484920             -5.89522857D-01   
 19      8.9751627              7.97233456D-01   
 20      4.8163589              7.63374521D-01   
 21      2.5866598              8.22674509D-02   
 22      1.3897663              2.21149472D-02   
 23      0.74684967            -1.15066266D-02   
 24      0.40138756             8.64597795D-03   
 25      0.21572963            -5.55898956D-03   
 26      0.11594728             3.07669655D-03   
 27      0.62317860E-01        -1.31847592D-03   
 28      0.33493819E-01         3.10033911D-04   
S   28
  1 81466050.0000000           -1.24602805D-07   
  2 16616094.0000000           -6.96203112D-07   
  3 3918843.6000000            -3.94726203D-06   
  4 1057867.4000000            -1.83016819D-05   
  5 322990.5300000             -7.29349714D-05   
  6 110076.8900000             -2.53819780D-04   
  7  41290.5020000             -7.79003761D-04   
  8  16805.3900000             -2.15359966D-03   
  9   7319.0317000             -5.30339137D-03   
 10   3366.9167000             -1.16454317D-02   
 11   1617.1036000             -2.10022762D-02   
 12    802.8171500             -2.63691806D-02   
 13    408.5492700              1.26327321D-03   
 14    211.6909000              9.65987961D-02   
 15    111.0992600              2.00066120D-01   
 16     58.8227310             -8.67847134D-03   
 17     31.3281730             -5.44847743D-01   
 18     16.7484920             -3.57198564D-01   
 19      8.9751627              6.39379995D-01   
 20      4.8163589              1.01201708D+00   
 21      2.5866598             -2.30192847D-01   
 22      1.3897663             -8.73262046D-01   
 23      0.74684967            -4.27500417D-01   
 24      0.40138756            -2.24887345D-02   
 25      0.21572963            -1.18295845D-02   
 26      0.11594728             5.65117045D-03   
 27      0.62317860E-01        -2.64905603D-03   
 28      0.33493819E-01         6.13849500D-04   
S   28
  1 81466050.0000000            4.07946735D-08   
  2 16616094.0000000            2.27994853D-07   
  3 3918843.6000000             1.29224563D-06   
  4 1057867.4000000             5.99372980D-06   
  5 322990.5300000              2.38759441D-05   
  6 110076.8900000              8.31332479D-05   
  7  41290.5020000              2.54989881D-04   
  8  16805.3900000              7.05543243D-04   
  9   7319.0317000              1.73579294D-03   
 10   3366.9167000              3.81795705D-03   
 11   1617.1036000              6.87400418D-03   
 12    802.8171500              8.67301559D-03   
 13    408.5492700             -4.73813755D-04   
 14    211.6909000             -3.17013603D-02   
 15    111.0992600             -6.65943639D-02   
 16     58.8227310              3.65302284D-03   
 17     31.3281730              1.84194395D-01   
 18     16.7484920              1.26900814D-01   
 19      8.9751627             -2.39739597D-01   
 20      4.8163589             -4.08007878D-01   
 21      2.5866598              1.26253859D-01   
 22      1.3897663              4.93538825D-01   
 23      0.74684967             4.37501701D-01   
 24      0.40138756            -9.26426206D-02   
 25      0.21572963            -4.95362154D-01   
 26      0.11594728            -5.26856900D-01   
 27      0.62317860E-01        -1.96461154D-01   
 28      0.33493819E-01        -1.58080374D-02   
P   24
  1 322990.5300000              1.45944593D-05   
  2 110076.8900000              6.81634921D-05   
  3  41290.5020000              3.63514318D-04   
  4  16805.3900000              1.56512997D-03   
  5   7319.0317000              6.02751279D-03   
  6   3366.9167000              2.03498599D-02   
  7   1617.1036000              6.02519345D-02   
  8    802.8171500              1.49317976D-01   
  9    408.5492700              2.86289331D-01   
 10    211.6909000              3.62854829D-01   
 11    111.0992600              2.32955620D-01   
 12     58.8227310              5.13651297D-02   
 13     31.3281730              2.22028480D-03   
 14     16.7484920             -1.88861547D-04   
 15      8.9751627              6.44749109D-05   
 16      4.8163589             -1.43575658D-04   
 17      2.5866598              1.09770026D-04   
 18      1.3897663             -7.34257880D-05   
 19      0.74684967             5.58791581D-05   
 20      0.40138756            -3.72033654D-05   
 21      0.21572963             2.39042976D-05   
 22      0.11594728            -1.36234728D-05   
 23      0.62317860E-01         6.10389428D-06   
 24      0.33493819E-01        -1.58989245D-06   
P   24
  1 322990.5300000              7.41076684D-06   
  2 110076.8900000              3.43687079D-05   
  3  41290.5020000              1.84902155D-04   
  4  16805.3900000              7.93671277D-04   
  5   7319.0317000              3.09274282D-03   
  6   3366.9167000              1.05332581D-02   
  7   1617.1036000              3.21464510D-02   
  8    802.8171500              8.30010429D-02   
  9    408.5492700              1.70887622D-01   
 10    211.6909000              2.25055803D-01   
 11    111.0992600              4.99201826D-02   
 12     58.8227310             -4.00372235D-01   
 13     31.3281730             -5.33558505D-01   
 14     16.7484920             -1.84809934D-01   
 15      8.9751627             -1.93131008D-02   
 16      4.8163589              1.13265666D-03   
 17      2.5866598             -1.41847265D-03   
 18      1.3897663              1.20971913D-03   
 19      0.74684967            -8.13201235D-04   
 20      0.40138756             5.77109494D-04   
 21      0.21572963            -3.71845932D-04   
 22      0.11594728             2.12604092D-04   
 23      0.62317860E-01        -9.59541336D-05   
 24      0.33493819E-01         2.49888774D-05   
P   24
  1 322990.5300000              3.72705590D-06   
  2 110076.8900000              1.71174629D-05   
  3  41290.5020000              9.30185352D-05   
  4  16805.3900000              3.96410171D-04   
  5   7319.0317000              1.55766765D-03   
  6   3366.9167000              5.29043180D-03   
  7   1617.1036000              1.63369302D-02   
  8    802.8171500              4.24198447D-02   
  9    408.5492700              8.94270195D-02   
 10    211.6909000              1.18166843D-01   
 11    111.0992600              9.99067297D-03   
 12     58.8227310             -3.23751928D-01   
 13     31.3281730             -4.52517882D-01   
 14     16.7484920              1.22297278D-01   
 15      8.9751627              6.46860433D-01   
 16      4.8163589              4.01526362D-01   
 17      2.5866598              5.02045180D-02   
 18      1.3897663              9.42367621D-03   
 19      0.74684967            -4.14370084D-03   
 20      0.40138756             3.17150411D-03   
 21      0.21572963            -2.08633376D-03   
 22      0.11594728             1.19713755D-03   
 23      0.62317860E-01        -5.45503001D-04   
 24      0.33493819E-01         1.43229136D-04   
P   24
  1 322990.5300000              1.59178066D-06   
  2 110076.8900000              7.21964785D-06   
  3  41290.5020000              3.97236206D-05   
  4  16805.3900000              1.67621087D-04   
  5   7319.0317000              6.64604237D-04   
  6   3366.9167000              2.24192820D-03   
  7   1617.1036000              6.98113100D-03   
  8    802.8171500              1.80519464D-02   
  9    408.5492700              3.84997801D-02   
 10    211.6909000              5.04395684D-02   
 11    111.0992600              3.27215069D-03   
 12     58.8227310             -1.54882962D-01   
 13     31.3281730             -2.12349216D-01   
 14     16.7484920              9.53438806D-02   
 15      8.9751627              4.66554918D-01   
 16      4.8163589              2.92291708D-01   
 17      2.5866598             -3.79044100D-01   
 18      1.3897663             -5.75934739D-01   
 19      0.74684967            -2.90495628D-01   
 20      0.40138756            -3.73516243D-02   
 21      0.21572963            -8.37658193D-03   
 22      0.11594728             2.55697459D-03   
 23      0.62317860E-01        -1.39666950D-03   
 24      0.33493819E-01         3.88469295D-04   
P   24
  1 322990.5300000              4.36867054D-07   
  2 110076.8900000              1.97402561D-06   
  3  41290.5020000              1.09017843D-05   
  4  16805.3900000              4.58653051D-05   
  5   7319.0317000              1.82332422D-04   
  6   3366.9167000              6.13754970D-04   
  7   1617.1036000              1.91554399D-03   
  8    802.8171500              4.94541503D-03   
  9    408.5492700              1.05773921D-02   
 10    211.6909000              1.38173179D-02   
 11    111.0992600              8.84166718D-04   
 12     58.8227310             -4.33111876D-02   
 13     31.3281730             -5.89292757D-02   
 14     16.7484920              2.79558196D-02   
 15      8.9751627              1.40379722D-01   
 16      4.8163589              8.44644221D-02   
 17      2.5866598             -1.44906338D-01   
 18      1.3897663             -2.29520561D-01   
 19      0.74684967            -1.44124228D-01   
 20      0.40138756             1.16201106D-01   
 21      0.21572963             3.59430747D-01   
 22      0.11594728             4.24717480D-01   
 23      0.62317860E-01         2.36500454D-01   
 24      0.33493819E-01         5.07802880D-02   
D   18
  1  16805.3900000              2.99702085D-05   
  2   7319.0317000              1.29444991D-04   
  3   3366.9167000              7.29089675D-04   
  4   1617.1036000              3.26199314D-03   
  5    802.8171500              1.33606398D-02   
  6    408.5492700              4.58623637D-02   
  7    211.6909000              1.29538666D-01   
  8    111.0992600              2.71200894D-01   
  9     58.8227310              3.77576977D-01   
 10     31.3281730              2.76428157D-01   
 11     16.7484920              8.19068735D-02   
 12      8.9751627              8.97565396D-03   
 13      4.8163589             -4.19876817D-05   
 14      2.5866598              4.43620388D-04   
 15      1.3897663             -2.77611542D-04   
 16      0.74684967             1.65511358D-04   
 17      0.40138756            -8.03859948D-05   
 18      0.21572963             2.35518209D-05   
D   18
  1  16805.3900000             -1.59628613D-05   
  2   7319.0317000             -6.69545182D-05   
  3   3366.9167000             -3.87974962D-04   
  4   1617.1036000             -1.71472519D-03   
  5    802.8171500             -7.15704720D-03   
  6    408.5492700             -2.46846342D-02   
  7    211.6909000             -7.16824699D-02   
  8    111.0992600             -1.50715609D-01   
  9     58.8227310             -1.98184372D-01   
 10     31.3281730             -3.19169278D-02   
 11     16.7484920              3.15570440D-01   
 12      8.9751627              4.73847030D-01   
 13      4.8163589              2.75796376D-01   
 14      2.5866598              5.57917419D-02   
 15      1.3897663              5.99498019D-03   
 16      0.74684967            -8.70514934D-04   
 17      0.40138756             5.25192382D-04   
 18      0.21572963            -1.81970787D-04   
D   18
  1  16805.3900000              5.87360299D-06   
  2   7319.0317000              2.39222225D-05   
  3   3366.9167000              1.42277925D-04   
  4   1617.1036000              6.19367645D-04   
  5    802.8171500              2.61694481D-03   
  6    408.5492700              8.98183935D-03   
  7    211.6909000              2.63450435D-02   
  8    111.0992600              5.51956807D-02   
  9     58.8227310              7.21681895D-02   
 10     31.3281730             -1.28150633D-03   
 11     16.7484920             -1.48816077D-01   
 12      8.9751627             -2.21399502D-01   
 13      4.8163589             -5.09172389D-02   
 14      2.5866598              2.76137442D-01   
 15      1.3897663              4.13936696D-01   
 16      0.74684967             3.28739849D-01   
 17      0.40138756             1.30248834D-01   
 18      0.21572963             3.69309602D-02   
F   12
  1   1617.1036000              7.25243568D-05   
  2    802.8171500              3.24534663D-04   
  3    408.5492700              1.80602562D-03   
  4    211.6909000              8.14470947D-03   
  5    111.0992600              3.09207363D-02   
  6     58.8227310              9.06828997D-02   
  7     31.3281730              2.01908669D-01   
  8     16.7484920              3.08890748D-01   
  9      8.9751627              3.27884630D-01   
 10      4.8163589              2.28371958D-01   
 11      2.5866598              8.95419716D-02   
 12      1.3897663              2.29928131D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Po
data:
POLONIUM
S   28
  1 89054877.0000000            3.20115333D-06   
  2 18260407.0000000            1.77206105D-05   
  3 4321596.7000000             1.00311012D-04   
  4 1168814.9000000             4.63393073D-04   
  5 357103.8700000              1.84655231D-03   
  6 121675.4200000              6.38588025D-03   
  7  45605.7770000              1.94244053D-02   
  8  18542.9820000              5.20064372D-02   
  9   8067.8727000              1.20682905D-01   
 10   3708.6113000              2.31070132D-01   
 11   1780.5116000              3.28432095D-01   
 12    883.9615700              2.80002776D-01   
 13    450.0462100              9.89460579D-02   
 14    233.3914900              7.06344323D-03   
 15    122.6356100              6.25962373D-04   
 16     65.0278260             -3.76251466D-04   
 17     34.6926010              1.85947570D-04   
 18     18.5823030             -1.53188374D-04   
 19      9.9779478              1.16399113D-04   
 20      5.3657299             -7.84592040D-05   
 21      2.8879084              5.69082843D-05   
 22      1.5550123             -4.11094681D-05   
 23      0.83749239             2.84452469D-05   
 24      0.45109815            -1.91633613D-05   
 25      0.24298423             1.20264874D-05   
 26      0.13088522            -6.58634603D-06   
 27      0.70502499E-01         2.76997090D-06   
 28      0.37976823E-01        -6.47387726D-07   
S   28
  1 89054877.0000000            1.06920742D-06   
  2 18260407.0000000            5.91862773D-06   
  3 4321596.7000000             3.35113240D-05   
  4 1168814.9000000             1.54874916D-04   
  5 357103.8700000              6.18232637D-04   
  6 121675.4200000              2.14752000D-03   
  7  45605.7770000              6.60899985D-03   
  8  18542.9820000              1.81700218D-02   
  9   8067.8727000              4.46732061D-02   
 10   3708.6113000              9.60609373D-02   
 11   1780.5116000              1.70141571D-01   
 12    883.9615700              2.04021165D-01   
 13    450.0462100              3.72512128D-02   
 14    233.3914900             -3.93417854D-01   
 15    122.6356100             -5.61665551D-01   
 16     65.0278260             -2.11327758D-01   
 17     34.6926010             -1.21955694D-02   
 18     18.5823030             -1.08179582D-03   
 19      9.9779478              7.19795456D-04   
 20      5.3657299             -2.17318574D-04   
 21      2.8879084              1.36892177D-04   
 22      1.5550123             -1.00755146D-04   
 23      0.83749239             5.67558202D-05   
 24      0.45109815            -3.72485602D-05   
 25      0.24298423             2.29327034D-05   
 26      0.13088522            -1.21930292D-05   
 27      0.70502499E-01         5.13650543D-06   
 28      0.37976823E-01        -1.18891281D-06   
S   28
  1 89054877.0000000            5.10240246D-07   
  2 18260407.0000000            2.82533829D-06   
  3 4321596.7000000             1.59913569D-05   
  4 1168814.9000000             7.39426681D-05   
  5 357103.8700000              2.95094548D-04   
  6 121675.4200000              1.02639156D-03   
  7  45605.7770000              3.16203165D-03   
  8  18542.9820000              8.73786332D-03   
  9   8067.8727000              2.16514299D-02   
 10   3708.6113000              4.75129997D-02   
 11   1780.5116000              8.71088025D-02   
 12    883.9615700              1.12177605D-01   
 13    450.0462100              2.08384691D-02   
 14    233.3914900             -3.15238388D-01   
 15    122.6356100             -6.49469633D-01   
 16     65.0278260             -1.34945399D-01   
 17     34.6926010              8.26981197D-01   
 18     18.5823030              5.21231273D-01   
 19      9.9779478              5.90687563D-02   
 20      5.3657299              4.85150910D-03   
 21      2.8879084             -1.78728075D-03   
 22      1.5550123              9.16592669D-04   
 23      0.83749239            -7.67721887D-04   
 24      0.45109815             4.82062034D-04   
 25      0.24298423            -2.96112988D-04   
 26      0.13088522             1.64112599D-04   
 27      0.70502499E-01        -6.78947994D-05   
 28      0.37976823E-01         1.59395935D-05   
S   28
  1 89054877.0000000           -2.57869283D-07   
  2 18260407.0000000           -1.42790775D-06   
  3 4321596.7000000            -8.08187825D-06   
  4 1168814.9000000            -3.73711596D-05   
  5 357103.8700000             -1.49149928D-04   
  6 121675.4200000             -5.18869941D-04   
  7  45605.7770000             -1.59916237D-03   
  8  18542.9820000             -4.42372809D-03   
  9   8067.8727000             -1.09855226D-02   
 10   3708.6113000             -2.42194701D-02   
 11   1780.5116000             -4.48106494D-02   
 12    883.9615700             -5.86953042D-02   
 13    450.0462100             -1.12484112D-02   
 14    233.3914900              1.81774816D-01   
 15    122.6356100              4.11213493D-01   
 16     65.0278260              9.48026984D-02   
 17     34.6926010             -9.24526791D-01   
 18     18.5823030             -7.44752278D-01   
 19      9.9779478              6.81364220D-01   
 20      5.3657299              8.51479189D-01   
 21      2.8879084              1.25126643D-01   
 22      1.5550123              2.15995512D-02   
 23      0.83749239            -9.91334844D-03   
 24      0.45109815             7.76549339D-03   
 25      0.24298423            -5.05235752D-03   
 26      0.13088522             2.78876438D-03   
 27      0.70502499E-01        -1.20118607D-03   
 28      0.37976823E-01         2.81533511D-04   
S   28
  1 89054877.0000000           -1.16882408D-07   
  2 18260407.0000000           -6.47410727D-07   
  3 4321596.7000000            -3.66295892D-06   
  4 1168814.9000000            -1.69448459D-05   
  5 357103.8700000             -6.75962024D-05   
  6 121675.4200000             -2.35303093D-04   
  7  45605.7770000             -7.24764049D-04   
  8  18542.9820000             -2.00725171D-03   
  9   8067.8727000             -4.98141650D-03   
 10   3708.6113000             -1.10128392D-02   
 11   1780.5116000             -2.03742013D-02   
 12    883.9615700             -2.69157705D-02   
 13    450.0462100             -4.99473712D-03   
 14    233.3914900              8.46885194D-02   
 15    122.6356100              1.98446196D-01   
 16     65.0278260              4.52211205D-02   
 17     34.6926010             -5.08296755D-01   
 18     18.5823030             -4.48079900D-01   
 19      9.9779478              5.28646573D-01   
 20      5.3657299              1.09427746D+00   
 21      2.8879084             -8.28665124D-02   
 22      1.5550123             -9.04592080D-01   
 23      0.83749239            -4.80768420D-01   
 24      0.45109815            -3.31358280D-02   
 25      0.24298423            -1.07046508D-02   
 26      0.13088522             4.60532302D-03   
 27      0.70502499E-01        -2.27124878D-03   
 28      0.37976823E-01         5.09643988D-04   
S   28
  1 89054877.0000000            4.01414840D-08   
  2 18260407.0000000            2.22395098D-07   
  3 4321596.7000000             1.25791916D-06   
  4 1168814.9000000             5.82100385D-06   
  5 357103.8700000              2.32125000D-05   
  6 121675.4200000              8.08399516D-05   
  7  45605.7770000              2.48863836D-04   
  8  18542.9820000              6.89761312D-04   
  9   8067.8727000              1.71038045D-03   
 10   3708.6113000              3.78691748D-03   
 11   1780.5116000              6.99628276D-03   
 12    883.9615700              9.28111440D-03   
 13    450.0462100              1.67068410D-03   
 14    233.3914900             -2.91589643D-02   
 15    122.6356100             -6.92193979D-02   
 16     65.0278260             -1.52361855D-02   
 17     34.6926010              1.80422206D-01   
 18     18.5823030              1.65621482D-01   
 19      9.9779478             -2.06586428D-01   
 20      5.3657299             -4.63960441D-01   
 21      2.8879084              6.18579768D-02   
 22      1.5550123              5.32243630D-01   
 23      0.83749239             5.07038447D-01   
 24      0.45109815            -9.60774695D-02   
 25      0.24298423            -5.33853143D-01   
 26      0.13088522            -5.26989184D-01   
 27      0.70502499E-01        -1.81720781D-01   
 28      0.37976823E-01        -1.40496874D-02   
P   24
  1 357103.8700000              1.27779160D-05   
  2 121675.4200000              5.97956113D-05   
  3  45605.7770000              3.19378182D-04   
  4  18542.9820000              1.38036215D-03   
  5   8067.8727000              5.33644030D-03   
  6   3708.6113000              1.81373618D-02   
  7   1780.5116000              5.42098292D-02   
  8    883.9615700              1.36778736D-01   
  9    450.0462100              2.70272884D-01   
 10    233.3914900              3.62247627D-01   
 11    122.6356100              2.55440359D-01   
 12     65.0278260              6.58532356D-02   
 13     34.6926010              3.36148630D-03   
 14     18.5823030             -3.70419049D-06   
 15      9.9779478             -5.92043770D-05   
 16      5.3657299             -6.81885137D-05   
 17      2.8879084              5.37060013D-05   
 18      1.5550123             -3.33405006D-05   
 19      0.83749239             2.87249682D-05   
 20      0.45109815            -1.88341811D-05   
 21      0.24298423             1.22217502D-05   
 22      0.13088522            -7.02541095D-06   
 23      0.70502499E-01         3.12642915D-06   
 24      0.37976823E-01        -8.19779119D-07   
P   24
  1 357103.8700000              6.49989618D-06   
  2 121675.4200000              3.01905329D-05   
  3  45605.7770000              1.62716663D-04   
  4  18542.9820000              7.00778121D-04   
  5   8067.8727000              2.74069835D-03   
  6   3708.6113000              9.38700391D-03   
  7   1780.5116000              2.88759120D-02   
  8    883.9615700              7.57350772D-02   
  9    450.0462100              1.60338611D-01   
 10    233.3914900              2.25846847D-01   
 11    122.6356100              8.73404101D-02   
 12     65.0278260             -3.48290467D-01   
 13     34.6926010             -5.52475494D-01   
 14     18.5823030             -2.25401816D-01   
 15      9.9779478             -2.58625748D-02   
 16      5.3657299              1.25236347D-04   
 17      2.8879084             -8.60588876D-04   
 18      1.5550123              8.01059379D-04   
 19      0.83749239            -5.11367025D-04   
 20      0.45109815             3.72335056D-04   
 21      0.24298423            -2.40734384D-04   
 22      0.13088522             1.37213505D-04   
 23      0.70502499E-01        -6.22289020D-05   
 24      0.37976823E-01         1.60934021D-05   
P   24
  1 357103.8700000              3.28034578D-06   
  2 121675.4200000              1.51080899D-05   
  3  45605.7770000              8.21407321D-05   
  4  18542.9820000              3.51579212D-04   
  5   8067.8727000              1.38511721D-03   
  6   3708.6113000              4.73395716D-03   
  7   1780.5116000              1.47175799D-02   
  8    883.9615700              3.88311467D-02   
  9    450.0462100              8.40261097D-02   
 10    233.3914900              1.19400243D-01   
 11    122.6356100              3.40101577D-02   
 12     65.0278260             -2.81766147D-01   
 13     34.6926010             -4.75519476D-01   
 14     18.5823030              3.27311487D-02   
 15      9.9779478              6.26817268D-01   
 16      5.3657299              4.56325068D-01   
 17      2.8879084              6.95325555D-02   
 18      1.5550123              1.06417389D-02   
 19      0.83749239            -4.21806284D-03   
 20      0.45109815             3.30151759D-03   
 21      0.24298423            -2.19742810D-03   
 22      0.13088522             1.25313067D-03   
 23      0.70502499E-01        -5.78029550D-04   
 24      0.37976823E-01         1.49776603D-04   
P   24
  1 357103.8700000              1.42523556D-06   
  2 121675.4200000              6.48514274D-06   
  3  45605.7770000              3.56843534D-05   
  4  18542.9820000              1.51289536D-04   
  5   8067.8727000              6.01196284D-04   
  6   3708.6113000              2.04137670D-03   
  7   1780.5116000              6.39714269D-03   
  8    883.9615700              1.68134406D-02   
  9    450.0462100              3.67809379D-02   
 10    233.3914900              5.19417605D-02   
 11    122.6356100              1.41909016D-02   
 12     65.0278260             -1.37053961D-01   
 13     34.6926010             -2.29234259D-01   
 14     18.5823030              4.65616980D-02   
 15      9.9779478              4.52923571D-01   
 16      5.3657299              3.60235256D-01   
 17      2.8879084             -3.28014906D-01   
 18      1.5550123             -6.00331939D-01   
 19      0.83749239            -3.17709756D-01   
 20      0.45109815            -4.28112815D-02   
 21      0.24298423            -8.88344749D-03   
 22      0.13088522             2.11640825D-03   
 23      0.70502499E-01        -1.56442292D-03   
 24      0.37976823E-01         3.32591241D-04   
P   24
  1 357103.8700000              4.18791813D-07   
  2 121675.4200000              1.89705914D-06   
  3  45605.7770000              1.04848821D-05   
  4  18542.9820000              4.42946812D-05   
  5   8067.8727000              1.76569251D-04   
  6   3708.6113000              5.98017816D-04   
  7   1780.5116000              1.87901626D-03   
  8    883.9615700              4.92914538D-03   
  9    450.0462100              1.08174551D-02   
 10    233.3914900              1.52304028D-02   
 11    122.6356100              4.17855273D-03   
 12     65.0278260             -4.10877972D-02   
 13     34.6926010             -6.82333781D-02   
 14     18.5823030              1.50289627D-02   
 15      9.9779478              1.46289197D-01   
 16      5.3657299              1.14223145D-01   
 17      2.8879084             -1.37700657D-01   
 18      1.5550123             -2.61428175D-01   
 19      0.83749239            -1.68488983D-01   
 20      0.45109815             1.39707014D-01   
 21      0.24298423             3.71082583D-01   
 22      0.13088522             4.10804548D-01   
 23      0.70502499E-01         2.29406991D-01   
 24      0.37976823E-01         5.52251802D-02   
D   18
  1  18542.9820000              2.56162904D-05   
  2   8067.8727000              1.10288448D-04   
  3   3708.6113000              6.27846020D-04   
  4   1780.5116000              2.81033345D-03   
  5    883.9615700              1.16423006D-02   
  6    450.0462100              4.04664917D-02   
  7    233.3914900              1.16990524D-01   
  8    122.6356100              2.53575835D-01   
  9     65.0278260              3.72788140D-01   
 10     34.6926010              2.97836102D-01   
 11     18.5823030              9.93714564D-02   
 12      9.9779478              1.21489636D-02   
 13      5.3657299              1.19461726D-04   
 14      2.8879084              4.36257044D-04   
 15      1.5550123             -2.64247827D-04   
 16      0.83749239             1.56906351D-04   
 17      0.45109815            -7.60136552D-05   
 18      0.24298423             2.24492133D-05   
D   18
  1  18542.9820000             -1.37728477D-05   
  2   8067.8727000             -5.71568397D-05   
  3   3708.6113000             -3.36839486D-04   
  4   1780.5116000             -1.48322552D-03   
  5    883.9615700             -6.27577398D-03   
  6    450.0462100             -2.18643776D-02   
  7    233.3914900             -6.50292730D-02   
  8    122.6356100             -1.41873500D-01   
  9     65.0278260             -2.00634827D-01   
 10     34.6926010             -6.51022907D-02   
 11     18.5823030              2.78960408D-01   
 12      9.9779478              4.76992399D-01   
 13      5.3657299              3.06859491D-01   
 14      2.8879084              6.89880036D-02   
 15      1.5550123              7.56017737D-03   
 16      0.83749239            -9.66587266D-04   
 17      0.45109815             5.80526309D-04   
 18      0.24298423            -2.09593258D-04   
D   18
  1  18542.9820000              5.25908067D-06   
  2   8067.8727000              2.10259972D-05   
  3   3708.6113000              1.28049590D-04   
  4   1780.5116000              5.53084235D-04   
  5    883.9615700              2.37538945D-03   
  6    450.0462100              8.21973945D-03   
  7    233.3914900              2.47257957D-02   
  8    122.6356100              5.37270617D-02   
  9     65.0278260              7.59507381D-02   
 10     34.6926010              1.31954384D-02   
 11     18.5823030             -1.38528132D-01   
 12      9.9779478             -2.32465426D-01   
 13      5.3657299             -8.37601374D-02   
 14      2.8879084              2.60655015D-01   
 15      1.5550123              4.26579020D-01   
 16      0.83749239             3.40253689D-01   
 17      0.45109815             1.29012445D-01   
 18      0.24298423             3.48458341D-02   
F   12
  1   1780.5116000              6.19563026D-05   
  2    883.9615700              2.73842049D-04   
  3    450.0462100              1.56121404D-03   
  4    233.3914900              7.05228934D-03   
  5    122.6356100              2.74729545D-02   
  6     65.0278260              8.24472124D-02   
  7     34.6926010              1.89936035D-01   
  8     18.5823030              3.02329079D-01   
  9      9.9779478              3.32554117D-01   
 10      5.3657299              2.40839225D-01   
 11      2.8879084              9.73124899D-02   
 12      1.5550123              2.52379839D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: At
data:
ASTATINE
S   28
  1 92596223.0000000            3.11131056D-06   
  2 19516300.0000000            1.64971322D-05   
  3 4704109.0000000             9.20440766D-05   
  4 1285396.9000000             4.21555338D-04   
  5 394156.9800000              1.68072292D-03   
  6 134109.5300000              5.85022419D-03   
  7  50020.4060000              1.79899197D-02   
  8  20198.4820000              4.88362260D-02   
  9   8722.0802000              1.15169178D-01   
 10   3980.6634000              2.24701834D-01   
 11   1899.5546000              3.27078939D-01   
 12    938.7987000              2.88495583D-01   
 13    476.6244600              1.07576563D-01   
 14    246.9027400              8.45777620D-03   
 15    129.7946000              7.17682352D-04   
 16     68.9476150             -4.41061659D-04   
 17     36.8899800              2.42629892D-04   
 18     19.8329240             -2.02039233D-04   
 19     10.6957600              1.54170084D-04   
 20      5.7792186             -1.06862499D-04   
 21      3.1262002              7.83260052D-05   
 22      1.6921404             -5.68750580D-05   
 23      0.91621247             3.96654502D-05   
 24      0.49616004            -2.68210885D-05   
 25      0.26870430             1.68592546D-05   
 26      0.14552478            -9.21885652D-06   
 27      0.78813725E-01         3.86011118D-06   
 28      0.42684207E-01        -8.96300169D-07   
S   28
  1 92596223.0000000            1.03979920D-06   
  2 19516300.0000000            5.51307537D-06   
  3 4704109.0000000             3.07670675D-05   
  4 1285396.9000000             1.40964011D-04   
  5 394156.9800000              5.62944676D-04   
  6 134109.5300000              1.96752214D-03   
  7  50020.4060000              6.11708581D-03   
  8  20198.4820000              1.70264014D-02   
  9   8722.0802000              4.24326717D-02   
 10   3980.6634000              9.25664444D-02   
 11   1899.5546000              1.66857120D-01   
 12    938.7987000              2.06396697D-01   
 13    476.6244600              5.31614034D-02   
 14    246.9027400             -3.71989639D-01   
 15    129.7946000             -5.68192573D-01   
 16     68.9476150             -2.30230943D-01   
 17     36.8899800             -1.51714295D-02   
 18     19.8329240             -1.32708030D-03   
 19     10.6957600              8.96805884D-04   
 20      5.7792186             -3.44685010D-04   
 21      3.1262002              2.38871864D-04   
 22      1.6921404             -1.77057962D-04   
 23      0.91621247             1.10001155D-04   
 24      0.49616004            -7.34894030D-05   
 25      0.26870430             4.59057805D-05   
 26      0.14552478            -2.46762609D-05   
 27      0.78813725E-01         1.03584491D-05   
 28      0.42684207E-01        -2.39170618D-06   
S   28
  1 92596223.0000000            4.96849745D-07   
  2 19516300.0000000            2.63498900D-06   
  3 4704109.0000000             1.47010489D-05   
  4 1285396.9000000             6.73827962D-05   
  5 394156.9800000              2.69055398D-04   
  6 134109.5300000              9.41413647D-04   
  7  50020.4060000              2.93016261D-03   
  8  20198.4820000              8.19384228D-03   
  9   8722.0802000              2.05789199D-02   
 10   3980.6634000              4.57614261D-02   
 11   1899.5546000              8.53440364D-02   
 12    938.7987000              1.13052351D-01   
 13    476.6244600              3.08715508D-02   
 14    246.9027400             -2.94854961D-01   
 15    129.7946000             -6.45580206D-01   
 16     68.9476150             -1.88449595D-01   
 17     36.8899800              7.98643530D-01   
 18     19.8329240              5.60506994D-01   
 19     10.6957600              7.04996760D-02   
 20      5.7792186              6.44119633D-03   
 21      3.1262002             -2.71532631D-03   
 22      1.6921404              1.64176930D-03   
 23      0.91621247            -1.32561111D-03   
 24      0.49616004             8.69575088D-04   
 25      0.26870430            -5.41470142D-04   
 26      0.14552478             3.00639991D-04   
 27      0.78813725E-01        -1.24805543D-04   
 28      0.42684207E-01         2.91541723D-05   
S   28
  1 92596223.0000000           -2.51954032D-07   
  2 19516300.0000000           -1.33614945D-06   
  3 4704109.0000000            -7.45507987D-06   
  4 1285396.9000000            -3.41690642D-05   
  5 394156.9800000             -1.36453047D-04   
  6 134109.5300000             -4.77479135D-04   
  7  50020.4060000             -1.48693611D-03   
  8  20198.4820000             -4.16151048D-03   
  9   8722.0802000             -1.04758732D-02   
 10   3980.6634000             -2.33932321D-02   
 11   1899.5546000             -4.40355068D-02   
 12    938.7987000             -5.92635985D-02   
 13    476.6244600             -1.67784061D-02   
 14    246.9027400              1.70259318D-01   
 15    129.7946000              4.07773554D-01   
 16     68.9476150              1.35991545D-01   
 17     36.8899800             -8.81058031D-01   
 18     19.8329240             -8.12513070D-01   
 19     10.6957600              6.09762681D-01   
 20      5.7792186              8.93396069D-01   
 21      3.1262002              1.54251737D-01   
 22      1.6921404              2.17381941D-02   
 23      0.91621247            -8.87592711D-03   
 24      0.49616004             7.17314137D-03   
 25      0.26870430            -4.72491243D-03   
 26      0.14552478             2.59149367D-03   
 27      0.78813725E-01        -1.11933434D-03   
 28      0.42684207E-01         2.60540328D-04   
S   28
  1 92596223.0000000           -1.15708620D-07   
  2 19516300.0000000           -6.13751388D-07   
  3 4704109.0000000            -3.42354142D-06   
  4 1285396.9000000            -1.56958533D-05   
  5 394156.9800000             -6.26608205D-05   
  6 134109.5300000             -2.19359942D-04   
  7  50020.4060000             -6.82856096D-04   
  8  20198.4820000             -1.91275677D-03   
  9   8722.0802000             -4.81379801D-03   
 10   3980.6634000             -1.07729407D-02   
 11   1899.5546000             -2.02933513D-02   
 12    938.7987000             -2.75011607D-02   
 13    476.6244600             -7.70910971D-03   
 14    246.9027400              8.04610385D-02   
 15    129.7946000              1.98872135D-01   
 16     68.9476150              6.76065565D-02   
 17     36.8899800             -4.91071713D-01   
 18     19.8329240             -4.92443396D-01   
 19     10.6957600              4.69798979D-01   
 20      5.7792186              1.13817612D+00   
 21      3.1262002              5.05966766D-03   
 22      1.6921404             -9.23097984D-01   
 23      0.91621247            -5.13411755D-01   
 24      0.49616004            -3.85868657D-02   
 25      0.26870430            -1.09294674D-02   
 26      0.14552478             4.31655080D-03   
 27      0.78813725E-01        -2.21896016D-03   
 28      0.42684207E-01         4.84136126D-04   
S   28
  1 92596223.0000000           -4.12818971D-08   
  2 19516300.0000000           -2.19021950D-07   
  3 4704109.0000000            -1.22136613D-06   
  4 1285396.9000000            -5.60135955D-06   
  5 394156.9800000             -2.23536053D-05   
  6 134109.5300000             -7.82889040D-05   
  7  50020.4060000             -2.43585455D-04   
  8  20198.4820000             -6.82799747D-04   
  9   8722.0802000             -1.71709707D-03   
 10   3980.6634000             -3.84807737D-03   
 11   1899.5546000             -7.23995746D-03   
 12    938.7987000             -9.84930141D-03   
 13    476.6244600             -2.71127286D-03   
 14    246.9027400              2.87843003D-02   
 15    129.7946000              7.20612430D-02   
 16     68.9476150              2.40334116D-02   
 17     36.8899800             -1.81245188D-01   
 18     19.8329240             -1.88970944D-01   
 19     10.6957600              1.90822649D-01   
 20      5.7792186              5.02519070D-01   
 21      3.1262002             -1.91760156D-02   
 22      1.6921404             -5.67663044D-01   
 23      0.91621247            -5.61862668D-01   
 24      0.49616004             1.11395618D-01   
 25      0.26870430             5.61374273D-01   
 26      0.14552478             5.25155066D-01   
 27      0.78813725E-01         1.69829110D-01   
 28      0.42684207E-01         1.28542623D-02   
P   24
  1 394156.9800000              1.12115821D-05   
  2 134109.5300000              5.28524533D-05   
  3  50020.4060000              2.85417704D-04   
  4  20198.4820000              1.25304591D-03   
  5   8722.0802000              4.91906523D-03   
  6   3980.6634000              1.69754029D-02   
  7   1899.5546000              5.14276298D-02   
  8    938.7987000              1.31540053D-01   
  9    476.6244600              2.63843132D-01   
 10    246.9027400              3.61560054D-01   
 11    129.7946000              2.64524459D-01   
 12     68.9476150              7.27413409D-02   
 13     36.8899800              4.10999910D-03   
 14     19.8329240              6.75612818D-05   
 15     10.6957600             -1.05441308D-04   
 16      5.7792186             -4.09809505D-05   
 17      3.1262002              3.30271046D-05   
 18      1.6921404             -1.82708956D-05   
 19      0.91621247             1.87777705D-05   
 20      0.49616004            -1.21042043D-05   
 21      0.26870430             7.91688205D-06   
 22      0.14552478            -4.61714156D-06   
 23      0.78813725E-01         2.01810534D-06   
 24      0.42684207E-01        -5.35215194D-07   
P   24
  1 394156.9800000              5.71132605D-06   
  2 134109.5300000              2.67316570D-05   
  3  50020.4060000              1.45596533D-04   
  4  20198.4820000              6.37118029D-04   
  5   8722.0802000              2.52844805D-03   
  6   3980.6634000              8.79262645D-03   
  7   1899.5546000              2.73845816D-02   
  8    938.7987000              7.27765992D-02   
  9    476.6244600              1.56216097D-01   
 10    246.9027400              2.25958429D-01   
 11    129.7946000              1.01823741D-01   
 12     68.9476150             -3.24037271D-01   
 13     36.8899800             -5.56331551D-01   
 14     19.8329240             -2.45298715D-01   
 15     10.6957600             -3.03298507D-02   
 16      5.7792186             -3.27489794D-04   
 17      3.1262002             -6.51760972D-04   
 18      1.6921404              6.48870501D-04   
 19      0.91621247            -3.94772566D-04   
 20      0.49616004             2.93341556D-04   
 21      0.26870430            -1.90615046D-04   
 22      0.14552478             1.07800271D-04   
 23      0.78813725E-01        -4.92032371D-05   
 24      0.42684207E-01         1.25391246D-05   
P   24
  1 394156.9800000              2.89300825D-06   
  2 134109.5300000              1.34359003D-05   
  3  50020.4060000              7.37623113D-05   
  4  20198.4820000              3.21009563D-04   
  5   8722.0802000              1.28236940D-03   
  6   3980.6634000              4.45228652D-03   
  7   1899.5546000              1.40037643D-02   
  8    938.7987000              3.74536259D-02   
  9    476.6244600              8.20983053D-02   
 10    246.9027400              1.20063787D-01   
 11    129.7946000              4.33233758D-02   
 12     68.9476150             -2.63533066D-01   
 13     36.8899800             -4.81997602D-01   
 14     19.8329240             -1.04604962D-02   
 15     10.6957600              6.10218192D-01   
 16      5.7792186              4.83620653D-01   
 17      3.1262002              8.24878766D-02   
 18      1.6921404              1.14372544D-02   
 19      0.91621247            -4.14946093D-03   
 20      0.49616004             3.29560709D-03   
 21      0.26870430            -2.21961058D-03   
 22      0.14552478             1.25229658D-03   
 23      0.78813725E-01        -5.84538886D-04   
 24      0.42684207E-01         1.48589601D-04   
P   24
  1 394156.9800000              1.27732880D-06   
  2 134109.5300000              5.86458011D-06   
  3  50020.4060000              3.25603072D-05   
  4  20198.4820000              1.40460404D-04   
  5   8722.0802000              5.65555812D-04   
  6   3980.6634000              1.95211477D-03   
  7   1899.5546000              6.18483636D-03   
  8    938.7987000              1.64881543D-02   
  9    476.6244600              3.65125487D-02   
 10    246.9027400              5.31435629D-02   
 11    129.7946000              1.86521673D-02   
 12     68.9476150             -1.30373258D-01   
 13     36.8899800             -2.37226557D-01   
 14     19.8329240              2.29269968D-02   
 15     10.6957600              4.46847933D-01   
 16      5.7792186              3.97002975D-01   
 17      3.1262002             -2.98777603D-01   
 18      1.6921404             -6.15458317D-01   
 19      0.91621247            -3.31516102D-01   
 20      0.49616004            -4.51688907D-02   
 21      0.26870430            -9.47488100D-03   
 22      0.14552478             1.75801295D-03   
 23      0.78813725E-01        -1.75693227D-03   
 24      0.42684207E-01         2.85672211D-04   
P   24
  1 394156.9800000              3.97891002D-07   
  2 134109.5300000              1.81767154D-06   
  3  50020.4060000              1.01413726D-05   
  4  20198.4820000              4.35789822D-05   
  5   8722.0802000              1.76059253D-04   
  6   3980.6634000              6.06041525D-04   
  7   1899.5546000              1.92552743D-03   
  8    938.7987000              5.12280433D-03   
  9    476.6244600              1.13827331D-02   
 10    246.9027400              1.65161979D-02   
 11    129.7946000              5.82933233D-03   
 12     68.9476150             -4.14903557D-02   
 13     36.8899800             -7.49288003D-02   
 14     19.8329240              8.27722176D-03   
 15     10.6957600              1.53670004D-01   
 16      5.7792186              1.34771805D-01   
 17      3.1262002             -1.35638235D-01   
 18      1.6921404             -2.90360131D-01   
 19      0.91621247            -1.86410096D-01   
 20      0.49616004             1.62402341D-01   
 21      0.26870430             3.86043683D-01   
 22      0.14552478             4.03554260D-01   
 23      0.78813725E-01         2.16284783D-01   
 24      0.42684207E-01         5.18832816D-02   
D   18
  1  20198.4820000              2.24867859D-05   
  2   8722.0802000              9.94726346D-05   
  3   3980.6634000              5.74347435D-04   
  4   1899.5546000              2.60900507D-03   
  5    938.7987000              1.09395335D-02   
  6    476.6244600              3.84151834D-02   
  7    246.9027400              1.12170036D-01   
  8    129.7946000              2.46244680D-01   
  9     68.9476150              3.69147000D-01   
 10     36.8899800              3.05642860D-01   
 11     19.8329240              1.07911707D-01   
 12     10.6957600              1.40808636D-02   
 13      5.7792186              2.19542446D-04   
 14      3.1262002              4.32286101D-04   
 15      1.6921404             -2.58256157D-04   
 16      0.91621247             1.52823316D-04   
 17      0.49616004            -7.35754143D-05   
 18      0.26870430             2.18548030D-05   
D   18
  1  20198.4820000             -1.21711611D-05   
  2   8722.0802000             -5.18361358D-05   
  3   3980.6634000             -3.09969230D-04   
  4   1899.5546000             -1.38477834D-03   
  5    938.7987000             -5.93018072D-03   
  6    476.6244600             -2.08679675D-02   
  7    246.9027400             -6.26746212D-02   
  8    129.7946000             -1.38666149D-01   
  9     68.9476150             -2.01166086D-01   
 10     36.8899800             -7.86805331D-02   
 11     19.8329240              2.60584900D-01   
 12     10.6957600              4.75529485D-01   
 13      5.7792186              3.21384758D-01   
 14      3.1262002              7.67249569D-02   
 15      1.6921404              8.49449370D-03   
 16      0.91621247            -9.83171496D-04   
 17      0.49616004             5.80326661D-04   
 18      0.26870430            -2.20156245D-04   
D   18
  1  20198.4820000              4.79305643D-06   
  2   8722.0802000              1.96368245D-05   
  3   3980.6634000              1.21443790D-04   
  4   1899.5546000              5.31995307D-04   
  5    938.7987000              2.31298250D-03   
  6    476.6244600              8.08304435D-03   
  7    246.9027400              2.45576573D-02   
  8    129.7946000              5.41243107D-02   
  9     68.9476150              7.85969156D-02   
 10     36.8899800              1.96403255D-02   
 11     19.8329240             -1.35135570D-01   
 12     10.6957600             -2.40412622D-01   
 13      5.7792186             -1.00988143D-01   
 14      3.1262002              2.54659250D-01   
 15      1.6921404              4.36567504D-01   
 16      0.91621247             3.43855331D-01   
 17      0.49616004             1.24253102D-01   
 18      0.26870430             3.26240548D-02   
F   12
  1   1899.5546000              5.72097901D-05   
  2    938.7987000              2.56701904D-04   
  3    476.6244600              1.48152247D-03   
  4    246.9027400              6.71720321D-03   
  5    129.7946000              2.63821751D-02   
  6     68.9476150              7.97005209D-02   
  7     36.8899800              1.85367092D-01   
  8     19.8329240              2.99113360D-01   
  9     10.6957600              3.33516944D-01   
 10      5.7792186              2.44852597D-01   
 11      3.1262002              9.99036540D-02   
 12      1.6921404              2.56369879D-02   


name: WTBS
description: MB Minimal Basis: 1 Function/AO
elt: Rn
data:
RADON
S   28
  1 98695815.0000000            2.94483336D-06   
  2 21091278.0000000            1.52731174D-05   
  3 5132142.2000000             8.45694320D-05   
  4 1410319.4000000             3.85346183D-04   
  5 433531.6300000              1.53554494D-03   
  6 147500.4300000              5.35904505D-03   
  7  54913.9150000              1.65696367D-02   
  8  22109.1790000              4.53524319D-02   
  9   9514.2752000              1.08235744D-01   
 10   4327.2744000              2.15007938D-01   
 11   2058.6291000              3.22250397D-01   
 12   1014.9288000              2.98837689D-01   
 13    514.3984400              1.21447588D-01   
 14    266.2228400              1.11707762D-02   
 15    139.9233600              8.70524984D-04   
 16     74.3615530             -5.47475604D-04   
 17     39.8261460              3.40754293D-04   
 18     21.4419260             -2.87602153D-04   
 19     11.5836860              2.20598992D-04   
 20      6.2713843             -1.56947223D-04   
 21      3.3996865              1.15847162D-04   
 22      1.8442936             -8.42378641D-05   
 23      1.0008923              5.89781407D-05   
 24      0.54328083            -3.98956965D-05   
 25      0.29491399             2.50696525D-05   
 26      0.16009530            -1.36933643D-05   
 27      0.86909090E-01         5.72166754D-06   
 28      0.47179407E-01        -1.32502107D-06   
S   28
  1 98695815.0000000            9.84723271D-07   
  2 21091278.0000000            5.10677942D-06   
  3 5132142.2000000             2.82845514D-05   
  4 1410319.4000000             1.28919607D-04   
  5 433531.6300000              5.14539990D-04   
  6 147500.4300000              1.80249083D-03   
  7  54913.9150000              5.63098142D-03   
  8  22109.1790000              1.57770990D-02   
  9   9514.2752000              3.96696204D-02   
 10   4327.2744000              8.75816215D-02   
 11   2058.6291000              1.61011468D-01   
 12   1014.9288000              2.07829277D-01   
 13    514.3984400              7.64937609D-02   
 14    266.2228400             -3.36378706D-01   
 15    139.9233600             -5.76121763D-01   
 16     74.3615530             -2.61223579D-01   
 17     39.8261460             -2.05558294D-02   
 18     21.4419260             -1.77482220D-03   
 19     11.5836860              1.22784686D-03   
 20      6.2713843             -5.99240821D-04   
 21      3.3996865              4.43538072D-04   
 22      1.8442936             -3.30278878D-04   
 23      1.0008923              2.18263224D-04   
 24      0.54328083            -1.47313743D-04   
 25      0.29491399             9.26371891D-05   
 26      0.16009530            -5.01707811D-05   
 27      0.86909090E-01         2.10221939D-05   
 28      0.47179407E-01        -4.85559616D-06   
S   28
  1 98695815.0000000            4.71136709D-07   
  2 21091278.0000000            2.44369766D-06   
  3 5132142.2000000             1.35324884D-05   
  4 1410319.4000000             6.16973794D-05   
  5 433531.6300000              2.46241464D-04   
  6 147500.4300000              8.63378951D-04   
  7  54913.9150000              2.70053705D-03   
  8  22109.1790000              7.59769418D-03   
  9   9514.2752000              1.92496563D-02   
 10   4327.2744000              4.32578514D-02   
 11   2058.6291000              8.21985751D-02   
 12   1014.9288000              1.13159515D-01   
 13    514.3984400              4.52435290D-02   
 14    266.2228400             -2.61784043D-01   
 15    139.9233600             -6.35693557D-01   
 16     74.3615530             -2.66716473D-01   
 17     39.8261460              7.52029847D-01   
 18     21.4419260              6.16442035D-01   
 19     11.5836860              8.77286434D-02   
 20      6.2713843              9.14853454D-03   
 21      3.3996865             -4.29551696D-03   
 22      1.8442936              2.88726560D-03   
 23      1.0008923             -2.27453629D-03   
 24      0.54328083             1.53027634D-03   
 25      0.29491399            -9.61440015D-04   
 26      0.16009530             5.33974847D-04   
 27      0.86909090E-01        -2.22379117D-04   
 28      0.47179407E-01         5.18086540D-05   
S   28
  1 98695815.0000000           -2.39716408D-07   
  2 21091278.0000000           -1.24317940D-06   
  3 5132142.2000000            -6.88567534D-06   
  4 1410319.4000000            -3.13873792D-05   
  5 433531.6300000             -1.25306547D-04   
  6 147500.4300000             -4.39300442D-04   
  7  54913.9150000             -1.37506493D-03   
  8  22109.1790000             -3.87054704D-03   
  9   9514.2752000             -9.83158615D-03   
 10   4327.2744000             -2.21709977D-02   
 11   2058.6291000             -4.25345474D-02   
 12   1014.9288000             -5.93799661D-02   
 13    514.3984400             -2.46912727D-02   
 14    266.2228400              1.51185126D-01   
 15    139.9233600              3.99004982D-01   
 16     74.3615530              1.94751905D-01   
 17     39.8261460             -8.12467824D-01   
 18     21.4419260             -8.98589840D-01   
 19     11.5836860              5.10876725D-01   
 20      6.2713843              9.41443752D-01   
 21      3.3996865              1.93786166D-01   
 22      1.8442936              2.12422256D-02   
 23      1.0008923             -6.88220608D-03   
 24      0.54328083             5.93189197D-03   
 25      0.29491399            -3.99016016D-03   
 26      0.16009530             2.16932995D-03   
 27      0.86909090E-01        -9.45486466D-04   
 28      0.47179407E-01         2.19144921D-04   
S   28
  1 98695815.0000000           -1.11476038D-07   
  2 21091278.0000000           -5.78160259D-07   
  3 5132142.2000000            -3.20201826D-06   
  4 1410319.4000000            -1.45974035D-05   
  5 433531.6300000             -5.82710817D-05   
  6 147500.4300000             -2.04321140D-04   
  7  54913.9150000             -6.39514069D-04   
  8  22109.1790000             -1.80087887D-03   
  9   9514.2752000             -4.57562216D-03   
 10   4327.2744000             -1.03328598D-02   
 11   2058.6291000             -1.98569464D-02   
 12   1014.9288000             -2.78562313D-02   
 13    514.3984400             -1.16314467D-02   
 14    266.2228400              7.24555313D-02   
 15    139.9233600              1.96206314D-01   
 16     74.3615530              9.96883203D-02   
 17     39.8261460             -4.58541522D-01   
 18     21.4419260             -5.46498891D-01   
 19     11.5836860              3.86703942D-01   
 20      6.2713843              1.17980558D+00   
 21      3.3996865              1.15913621D-01   
 22      1.8442936             -9.41191433D-01   
 23      1.0008923             -5.49991828D-01   
 24      0.54328083            -4.56412819D-02   
 25      0.29491399            -1.06116336D-02   
 26      0.16009530             3.66783495D-03   
 27      0.86909090E-01        -2.00989692D-03   
 28      0.47179407E-01         4.24837899D-04   
S   28
  1 98695815.0000000           -4.10414653D-08   
  2 21091278.0000000           -2.12903598D-07   
  3 5132142.2000000            -1.17880851D-06   
  4 1410319.4000000            -5.37553965D-06   
  5 433531.6300000             -2.14514317D-05   
  6 147500.4300000             -7.52471705D-05   
  7  54913.9150000             -2.35412366D-04   
  8  22109.1790000             -6.63351022D-04   
  9   9514.2752000             -1.68432029D-03   
 10   4327.2744000             -3.80833525D-03   
 11   2058.6291000             -7.31129643D-03   
 12   1014.9288000             -1.02913887D-02   
 13    514.3984400             -4.25436950D-03   
 14    266.2228400              2.67526953D-02   
 15    139.9233600              7.33252971D-02   
 16     74.3615530              3.69666815D-02   
 17     39.8261460             -1.74780801D-01   
 18     21.4419260             -2.15878177D-01   
 19     11.5836860              1.61628970D-01   
 20      6.2713843              5.38035631D-01   
 21      3.3996865              3.84969208D-02   
 22      1.8442936             -5.98432124D-01   
 23      1.0008923             -6.17639185D-01   
 24      0.54328083             1.21433866D-01   
 25      0.29491399             5.86217655D-01   
 26      0.16009530             5.25076503D-01   
 27      0.86909090E-01         1.59560544D-01   
 28      0.47179407E-01         1.12605537D-02   
P   24
  1 433531.6300000              9.89199134D-06   
  2 147500.4300000              4.67414821D-05   
  3  54913.9150000              2.53553370D-04   
  4  22109.1790000              1.12191711D-03   
  5   9514.2752000              4.44053079D-03   
  6   4327.2744000              1.54811293D-02   
  7   2058.6291000              4.74295075D-02   
  8   1014.9288000              1.23242750D-01   
  9    514.3984400              2.52751091D-01   
 10    266.2228400              3.59308122D-01   
 11    139.9233600              2.79018055D-01   
 12     74.3615530              8.44442786D-02   
 13     39.8261460              5.50161652D-03   
 14     21.4419260              1.90462205D-04   
 15     11.5836860             -1.86433094D-04   
 16      6.2713843              1.16448758D-05   
 17      3.3996865             -7.95603980D-06   
 18      1.8442936              1.16311183D-05   
 19      1.0008923             -1.74881392D-06   
 20      0.54328083             1.88555285D-06   
 21      0.29491399            -9.38971987D-07   
 22      0.16009530             4.78900933D-07   
 23      0.86909090E-01        -2.06732269D-07   
 24      0.47179407E-01         5.15619998D-08   
P   24
  1 433531.6300000              5.04579018D-06   
  2 147500.4300000              2.36831144D-05   
  3  54913.9150000              1.29497358D-04   
  4  22109.1790000              5.71296382D-04   
  5   9514.2752000              2.28418919D-03   
  6   4327.2744000              8.02282698D-03   
  7   2058.6291000              2.52305227D-02   
  8   1014.9288000              6.80424145D-02   
  9    514.3984400              1.49032720D-01   
 10    266.2228400              2.24845197D-01   
 11    139.9233600              1.23498582D-01   
 12     74.3615530             -2.86884563D-01   
 13     39.8261460             -5.61052005D-01   
 14     21.4419260             -2.74899753D-01   
 15     11.5836860             -3.71352517D-02   
 16      6.2713843             -1.15840867D-03   
 17      3.3996865             -2.40254217D-04   
 18      1.8442936              3.35404374D-04   
 19      1.0008923             -1.59091909D-04   
 20      0.54328083             1.31376674D-04   
 21      0.29491399            -8.53559513D-05   
 22      0.16009530             4.86504558D-05   
 23      0.86909090E-01        -2.19781340D-05   
 24      0.47179407E-01         5.67346310D-06   
P   24
  1 433531.6300000              2.56433877D-06   
  2 147500.4300000              1.19593011D-05   
  3  54913.9150000              6.58219273D-05   
  4  22109.1790000              2.89108393D-04   
  5   9514.2752000              1.16233764D-03   
  6   4327.2744000              4.07900899D-03   
  7   2058.6291000              1.29407225D-02   
  8   1014.9288000              3.51387113D-02   
  9    514.3984400              7.84817037D-02   
 10    266.2228400              1.20065660D-01   
 11    139.9233600              5.71935580D-02   
 12     74.3615530             -2.35005249D-01   
 13     39.8261460             -4.88420765D-01   
 14     21.4419260             -6.92313005D-02   
 15     11.5836860              5.86161077D-01   
 16      6.2713843              5.18102929D-01   
 17      3.3996865              9.99806109D-02   
 18      1.8442936              1.22771803D-02   
 19      1.0008923             -3.87867636D-03   
 20      0.54328083             3.15589131D-03   
 21      0.29491399            -2.12847264D-03   
 22      0.16009530             1.22030904D-03   
 23      0.86909090E-01        -5.57266332D-04   
 24      0.47179407E-01         1.44762116D-04   
P   24
  1 433531.6300000              1.15015383D-06   
  2 147500.4300000              5.30818682D-06   
  3  54913.9150000              2.95148349D-05   
  4  22109.1790000              1.28616291D-04   
  5   9514.2752000              5.20762144D-04   
  6   4327.2744000              1.81814403D-03   
  7   2058.6291000              5.80594120D-03   
  8   1014.9288000              1.57245173D-02   
  9    514.3984400              3.54484446D-02   
 10    266.2228400              5.40726615D-02   
 11    139.9233600              2.53664264D-02   
 12     74.3615530             -1.18186360D-01   
 13     39.8261460             -2.45467865D-01   
 14     21.4419260             -1.03205995D-02   
 15     11.5836860              4.33713572D-01   
 16      6.2713843              4.40665787D-01   
 17      3.3996865             -2.60409310D-01   
 18      1.8442936             -6.33308280D-01   
 19      1.0008923             -3.48613024D-01   
 20      0.54328083            -4.78448073D-02   
 21      0.29491399            -8.96299068D-03   
 22      0.16009530             2.29190282D-03   
 23      0.86909090E-01        -1.37783544D-03   
 24      0.47179407E-01         3.53634949D-04   
P   24
  1 433531.6300000              3.73018813D-07   
  2 147500.4300000              1.71186862D-06   
  3  54913.9150000              9.57068064D-06   
  4  22109.1790000              4.15267509D-05   
  5   9514.2752000              1.68762802D-04   
  6   4327.2744000              5.87439807D-04   
  7   2058.6291000              1.88161959D-03   
  8   1014.9288000              5.08476386D-03   
  9    514.3984400              1.15039311D-02   
 10    266.2228400              1.74935880D-02   
 11    139.9233600              8.25959913D-03   
 12     74.3615530             -3.92209590D-02   
 13     39.8261460             -8.08252543D-02   
 14     21.4419260             -2.60660616D-03   
 15     11.5836860              1.55877734D-01   
 16      6.2713843              1.57533377D-01   
 17      3.3996865             -1.26750687D-01   
 18      1.8442936             -3.16907558D-01   
 19      1.0008923             -2.05502500D-01   
 20      0.54328083             1.80429756D-01   
 21      0.29491399             4.02919892D-01   
 22      0.16009530             4.00379215D-01   
 23      0.86909090E-01         2.02812457D-01   
 24      0.47179407E-01         4.49889406D-02   
D   18
  1  22109.1790000              1.95054683D-05   
  2   9514.2752000              8.71824017D-05   
  3   4327.2744000              5.08823847D-04   
  4   2058.6291000              2.33066238D-03   
  5   1014.9288000              9.88539458D-03   
  6    514.3984400              3.51593418D-02   
  7    266.2228400              1.04410977D-01   
  8    139.9233600              2.34699610D-01   
  9     74.3615530              3.63964346D-01   
 10     39.8261460              3.18075976D-01   
 11     21.4419260              1.21040868D-01   
 12     11.5836860              1.70667357D-02   
 13      6.2713843              4.09304247D-04   
 14      3.3996865              4.06798244D-04   
 15      1.8442936             -2.34560665D-04   
 16      1.0008923              1.37836089D-04   
 17      0.54328083            -6.59114155D-05   
 18      0.29491399             1.98578599D-05   
D   18
  1  22109.1790000             -1.06315966D-05   
  2   9514.2752000             -4.56354669D-05   
  3   4327.2744000             -2.76320203D-04   
  4   2058.6291000             -1.24330498D-03   
  5   1014.9288000             -5.38786643D-03   
  6    514.3984400             -1.91892246D-02   
  7    266.2228400             -5.85940185D-02   
  8    139.9233600             -1.32978223D-01   
  9     74.3615530             -2.01239195D-01   
 10     39.8261460             -9.81656443D-02   
 11     21.4419260              2.34878598D-01   
 12     11.5836860              4.73673659D-01   
 13      6.2713843              3.41110689D-01   
 14      3.3996865              8.70932260D-02   
 15      1.8442936              9.73059369D-03   
 16      1.0008923             -9.85463300D-04   
 17      0.54328083             5.75878468D-04   
 18      0.29491399            -2.30456129D-04   
D   18
  1  22109.1790000              4.30820111D-06   
  2   9514.2752000              1.77269048D-05   
  3   4327.2744000              1.11313873D-04   
  4   2058.6291000              4.90364162D-04   
  5   1014.9288000              2.15944497D-03   
  6    514.3984400              7.63309182D-03   
  7    266.2228400              2.35864663D-02   
  8    139.9233600              5.33312116D-02   
  9     74.3615530              8.09471494D-02   
 10     39.8261460              2.92286717D-02   
 11     21.4419260             -1.27530560D-01   
 12     11.5836860             -2.47539299D-01   
 13      6.2713843             -1.23267901D-01   
 14      3.3996865              2.44272005D-01   
 15      1.8442936              4.47303082D-01   
 16      1.0008923              3.49694311D-01   
 17      0.54328083             1.21454316D-01   
 18      0.29491399             3.10263046D-02   
F   12
  1   2058.6291000              5.06826222D-05   
  2   1014.9288000              2.27816843D-04   
  3    514.3984400              1.34079821D-03   
  4    266.2228400              6.10893549D-03   
  5    139.9233600              2.44193016D-02   
  6     74.3615530              7.49886809D-02   
  7     39.8261460              1.78097974D-01   
  8     21.4419260              2.94701565D-01   
  9     11.5836860              3.36005664D-01   
 10      6.2713843              2.52129183D-01   
 11      3.3996865              1.04486313D-01   
 12      1.8442936              2.66013197D-02   


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Sc
data:
SCANDIUM
S   6
  1 188961.0000000              0.0002500        
  2  28491.4000000              0.0019300        
  3   6572.4300000              0.0098000        
  4   1881.0300000              0.0394000        
  5    617.9790000              0.1253200        
  6    225.1270000              0.2957700        
S   2
  1     88.5664000              0.4190000        
  2     36.5819000              0.2413900        
S   1
  1     11.0358000              1.0000000        
S   1
  1      4.4906300              1.0000000        
S   1
  1      1.1293500              1.0000000        
S   1
  1      0.4546130              1.0000000        
S   1
  1      0.0775330              1.0000000        
S   1
  1      0.0307900              1.0000000        
P   3
  1   1113.8200000              0.0022300        
  2    266.2440000              0.0176400        
  3     86.5763000              0.0812300        
P   3
  1     32.5934000              0.2404000        
  2     13.2190000              0.4251700        
  3      5.5835700              0.3597200        
P   1
  1      2.1859400              1.0000000        
P   2
  1      0.8950110              0.5760200        
  2      0.3519750              0.3089000        
P   1
  1      0.1346200              1.0000000        
P   1
  1      0.0465480              1.0000000        
D   3
  1     22.4283000              0.0214000        
  2      6.0347900              0.1130400        
  3      1.9790500              0.3139300        
D   1
  1      0.6667500              1.0000000        
D   1
  1      0.2182310              1.0000000        
D   1
  1      0.0588000              1.0000000        
F   3
  1      0.8918597              0.1737857        
  2      0.3198414              0.5973381        
  3      0.1369599              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   6
  1 206082.0000000              0.0002500        
  2  31226.8000000              0.0019300        
  3   7199.3200000              0.0098800        
  4   2048.7500000              0.0399400        
  5    670.7900000              0.1273700        
  6    243.6500000              0.2998100        
S   2
  1     95.9250000              0.4182500        
  2     39.8101000              0.2358200        
S   1
  1     12.2205000              1.0000000        
S   1
  1      5.0088200              1.0000000        
S   1
  1      1.2856900              1.0000000        
S   1
  1      0.5128060              1.0000000        
S   1
  1      0.0855760              1.0000000        
S   1
  1      0.0333020              1.0000000        
P   3
  1   1264.7000000              0.0021400        
  2    301.2300000              0.0172500        
  3     96.9777000              0.0811700        
P   3
  1     36.3727000              0.2414300        
  2     14.7814000              0.4263100        
  3      6.2746500              0.3571400        
P   1
  1      2.4787800              1.0000000        
P   2
  1      1.0161800              0.5770900        
  2      0.3981620              0.2998600        
P   1
  1      0.1523400              1.0000000        
P   1
  1      0.0510800              1.0000000        
D   3
  1     25.9924000              0.0225300        
  2      7.0863400              0.1196100        
  3      2.3487100              0.3270000        
D   1
  1      0.8001980              1.0000000        
D   1
  1      0.2620490              1.0000000        
D   1
  1      0.0720000              1.0000000        
F   3
  1      1.3935308              0.1737857        
  2      0.4997522              0.5973381        
  3      0.2139998              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: V
data:
VANADIUM
S   6
  1 226878.0000000              0.0002500        
  2  33899.6000000              0.0019700        
  3   7720.2400000              0.0101700        
  4   2191.5300000              0.0409800        
  5    719.1690000              0.1298000        
  6    262.0860000              0.3025900        
S   2
  1    103.6530000              0.4163700        
  2     43.2548000              0.2313300        
S   1
  1     13.5088000              1.0000000        
S   1
  1      5.5671500              1.0000000        
S   1
  1      1.4517400              1.0000000        
S   1
  1      0.5744450              1.0000000        
S   1
  1      0.0928200              1.0000000        
S   1
  1      0.0355320              1.0000000        
P   3
  1   1398.4300000              0.0021400        
  2    331.5710000              0.0173500        
  3    107.0020000              0.0812800        
P   3
  1     40.3183000              0.2413000        
  2     16.4635000              0.4262200        
  3      7.0235200              0.3557800        
P   1
  1      2.7902500              1.0000000        
P   2
  1      1.1460900              0.5769300        
  2      0.4472720              0.2947000        
P   1
  1      0.1668720              1.0000000        
P   1
  1      0.0545670              1.0000000        
D   3
  1     30.2212000              0.0227000        
  2      8.2721800              0.1224800        
  3      2.7582300              0.3328600        
D   1
  1      0.9421370              1.0000000        
D   1
  1      0.3052980              1.0000000        
D   1
  1      0.0820000              1.0000000        
F   3
  1      2.0066843              0.1737857        
  2      0.7196432              0.5973381        
  3      0.3081598              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Cr
data:
CHROMIUM
S   6
  1 236658.0000000              0.0002700        
  2  35364.0000000              0.0020800        
  3   8058.3100000              0.0107100        
  4   2294.2300000              0.0428400        
  5    756.1180000              0.1342000        
  6    277.0000000              0.3079800        
S   2
  1    110.1790000              0.4136100        
  2     46.3710000              0.2224100        
S   1
  1     14.8215000              1.0000000        
S   1
  1      6.1326200              1.0000000        
S   1
  1      1.6295900              1.0000000        
S   1
  1      0.6411770              1.0000000        
S   1
  1      0.0995110              1.0000000        
S   1
  1      0.0375880              1.0000000        
P   3
  1   1478.7700000              0.0022800        
  2    351.4900000              0.0183600        
  3    113.8260000              0.0850300        
P   3
  1     43.1567000              0.2476100        
  2     17.7775000              0.4271800        
  3      7.6612800              0.3457900        
P   1
  1      3.0776500              1.0000000        
P   2
  1      1.2661900              0.5749000        
  2      0.4935340              0.2847300        
P   1
  1      0.1810100              1.0000000        
P   1
  1      0.0579200              1.0000000        
D   3
  1     34.0221000              0.0232800        
  2      9.4316100              0.1256400        
  3      3.1591800              0.3389700        
D   1
  1      1.0799500              1.0000000        
D   1
  1      0.3465820              1.0000000        
D   1
  1      0.0912000              1.0000000        
F   3
  1      2.7313203              0.1737857        
  2      0.9795143              0.5973381        
  3      0.4194397              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Mn
data:
MANGANESE
S   6
  1 243694.0000000              0.0002900        
  2  35995.0000000              0.0022500        
  3   8223.5600000              0.0115200        
  4   2353.1200000              0.0455900        
  5    780.9650000              0.1403900        
  6    288.5190000              0.3147200        
S   2
  1    115.7010000              0.4097400        
  2     49.1175000              0.2107900        
S   1
  1     16.0885000              1.0000000        
S   1
  1      6.7043000              1.0000000        
S   1
  1      1.8051700              1.0000000        
S   1
  1      0.7030110              1.0000000        
S   1
  1      0.1063850              1.0000000        
S   1
  1      0.0396160              1.0000000        
P   3
  1   1500.3900000              0.0025800        
  2    358.8000000              0.0204800        
  3    116.6990000              0.0929300        
P   3
  1     44.6132000              0.2607400        
  2     18.5985000              0.4288900        
  3      8.1377800              0.3259800        
P   1
  1      3.3373400              1.0000000        
P   2
  1      1.3789500              0.5693500        
  2      0.5386390              0.2735400        
P   1
  1      0.1914750              1.0000000        
P   1
  1      0.0604200              1.0000000        
D   3
  1     37.8977000              0.0240900        
  2     10.5201000              0.1307300        
  3      3.5376400              0.3464800        
D   1
  1      1.2121700              1.0000000        
D   1
  1      0.3879120              1.0000000        
D   1
  1      0.1054000              1.0000000        
F   3
  1      3.5674388              0.1737857        
  2      1.2793657              0.5973381        
  3      0.5478396              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Fe
data:
IRON
S   6
  1 257539.0000000              0.0002900        
  2  38636.9000000              0.0022600        
  3   8891.4400000              0.0115200        
  4   2544.0100000              0.0456600        
  5    844.7770000              0.1403500        
  6    312.5270000              0.3142000        
S   2
  1    125.5930000              0.4087800        
  2     53.4987000              0.2116300        
S   1
  1     17.7151000              1.0000000        
S   1
  1      7.3767700              1.0000000        
S   1
  1      2.0184700              1.0000000        
S   1
  1      0.7799350              1.0000000        
S   1
  1      0.1142200              1.0000000        
S   1
  1      0.0418890              1.0000000        
P   3
  1   1678.4000000              0.0024900        
  2    396.3920000              0.0201500        
  3    128.5880000              0.0919900        
P   3
  1     49.1158000              0.2599100        
  2     20.5035000              0.4288700        
  3      8.9871200              0.3269100        
P   1
  1      3.6824900              1.0000000        
P   2
  1      1.5217500              0.5692500        
  2      0.5926840              0.2686300        
P   1
  1      0.2023700              1.0000000        
P   1
  1      0.0627600              1.0000000        
D   3
  1     41.4526000              0.0251100        
  2     11.5403000              0.1362600        
  3      3.8854300              0.3532300        
D   1
  1      1.3238000              1.0000000        
D   1
  1      0.4166800              1.0000000        
D   1
  1      0.1133000              1.0000000        
F   3
  1      4.5150397              0.1737857        
  2      1.6191972              0.5973381        
  3      0.6933595              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Co
data:
COBALT
S   6
  1 270991.0000000              0.0003100        
  2  39734.8000000              0.0024200        
  3   9057.4600000              0.0123800        
  4   2598.2100000              0.0484900        
  5    868.2000000              0.1467200        
  6    323.4310000              0.3212700        
S   2
  1    130.8600000              0.4049700        
  2     56.1219000              0.1996100        
S   1
  1     18.9219000              1.0000000        
S   1
  1      7.9523800              1.0000000        
S   1
  1      2.1975400              1.0000000        
S   1
  1      0.8467130              1.0000000        
S   1
  1      0.1222660              1.0000000        
S   1
  1      0.0441720              1.0000000        
P   3
  1   1636.2100000              0.0029600        
  2    390.9030000              0.0233600        
  3    127.8840000              0.1034300        
P   3
  1     49.2413000              0.2795400        
  2     20.7512000              0.4326800        
  3      9.2036800              0.2986100        
P   1
  1      3.8177900              1.0000000        
P   2
  1      1.5876200              0.5562500        
  2      0.6246600              0.2434500        
P   1
  1      0.2119620              1.0000000        
P   1
  1      0.0651030              1.0000000        
D   3
  1     44.9774000              0.0262700        
  2     12.5690000              0.1418200        
  3      4.2442200              0.3594200        
D   1
  1      1.4433000              1.0000000        
D   1
  1      0.4499650              1.0000000        
D   1
  1      0.1219000              1.0000000        
F   3
  1      5.5741231              0.1737857        
  2      1.9990089              0.5973381        
  3      0.8559993              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Ni
data:
NICKEL
S   6
  1 284878.0000000              0.0003200        
  2  41997.9000000              0.0024600        
  3   9627.6700000              0.0125400        
  4   2761.9600000              0.0492600        
  5    920.4880000              0.1495000        
  6    341.8050000              0.3264000        
S   2
  1    138.0230000              0.4047400        
  2     59.2587000              0.1918600        
S   1
  1     20.3712000              1.0000000        
S   1
  1      8.5940000              1.0000000        
S   1
  1      2.3941700              1.0000000        
S   1
  1      0.9181690              1.0000000        
S   1
  1      0.1301760              1.0000000        
S   1
  1      0.0463920              1.0000000        
P   3
  1   1774.1800000              0.0029500        
  2    423.4030000              0.0233700        
  3    138.3110000              0.1040600        
P   3
  1     53.1703000              0.2822600        
  2     22.3874000              0.4348600        
  3      9.9284800              0.2944200        
P   1
  1      4.1162500              1.0000000        
P   2
  1      1.7103100              0.5527300        
  2      0.6725280              0.2344100        
P   1
  1      0.2198820              1.0000000        
P   1
  1      0.0666700              1.0000000        
D   3
  1     48.9403000              0.0270600        
  2     13.7169000              0.1459800        
  3      4.6395100              0.3641800        
D   1
  1      1.5743300              1.0000000        
D   1
  1      0.4864090              1.0000000        
D   1
  1      0.1316000              1.0000000        
F   3
  1      6.7446890              0.1737857        
  2      2.4188007              0.5973381        
  3      1.0357592              0.3929396        


name: Wachters+f
description: VDZP Valence Double Zeta + Polarization on All Atoms
elt: Cu
data:
COPPER
S   6
  1 337200.0000000              0.0002800        
  2  50072.9000000              0.0021700        
  3  11373.4000000              0.0112200        
  4   3239.8200000              0.0446210        
  5   1071.9700000              0.1383600        
  6    395.0990000              0.3125500        
S   2
  1    158.3990000              0.4106000        
  2     67.3591000              0.2145300        
S   1
  1     22.2983000              1.0000000        
S   1
  1      9.3935700              1.0000000        
S   1
  1      2.5784800              1.0000000        
S   1
  1      0.9640800              1.0000000        
S   1
  1      0.1133030              1.0000000        
S   1
  1      0.0407910              1.0000000        
P   3
  1   2245.2900000              0.0022600        
  2    532.1060000              0.0184100        
  3    172.1950000              0.0864600        
P   3
  1     65.3239000              0.2545000        
  2     27.0551000              0.4341900        
  3     11.7435000              0.3339000        
P   1
  1      4.6938200              1.0000000        
P   2
  1      1.9066700              0.5693600        
  2      0.7114450              0.2470200        
P   1
  1      0.2325980              1.0000000        
P   1
  1      0.0692990              1.0000000        
D   3
  1     48.5439000              0.0309700        
  2     13.5490000              0.1619600        
  3      4.5162800              0.3781200        
D   1
  1      1.4732900              1.0000000        
D   1
  1      0.4148750              1.0000000        
D   1
  1      0.1491000              1.0000000        
F   3
  1      8.0267373              0.1737857        
  2      2.8785728              0.5973381        
  3      1.2326390              0.3929396        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: H
data:
HYDROGEN
S   3
  1     15.6752927              0.0186886        
  2      3.6063578              0.0631670        
  3      1.2080016              0.1204609        
S   1
  1      0.4726794              1.0000000        
S   1
  1      0.2018100              1.0000000        
P   2
  1      2.0281365              1.0000000        
  2      0.5358730              1.0000000        
D   1
  1      2.2165124              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: He
data:
HELIUM
S   3
  1     50.6720580              0.0651007        
  2     12.6182260              0.2103093        
  3      3.8995171              0.3791436        
S   1
  1      1.4088465              1.0000000        
S   1
  1      0.5393970              1.0000000        
P   2
  1      4.0000000              1.0000000        
  2      1.0000000              1.0000000        
D   1
  1      4.0000000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Li
data:
LITHIUM
S   7
  1    498.3689730              0.0207908        
  2    162.9342738              0.0542177        
  3     57.3246735              0.1776783        
  4     21.6427314              0.4181150        
  5      8.7345375              0.6535245        
  6      3.7491039              0.5492618        
  7      1.7006754              0.1701425        
S   1
  1      0.8090859              1.0000000        
S   1
  1      0.4000933              1.0000000        
S   1
  1      0.2035793              1.0000000        
S   1
  1      0.1054201              1.0000000        
S   1
  1      0.0549139              1.0000000        
P   2
  1     10.7024696              0.0072923        
  2      3.6551543              0.0060940        
P   1
  1      1.2464013              1.0000000        
P   1
  1      0.4246282              1.0000000        
P   1
  1      0.1446192              1.0000000        
D   2
  1      1.1510647             -0.0014314        
  2      0.6019112              0.0038969        
D   1
  1      0.3109573              1.0000000        
D   1
  1      0.1600032              1.0000000        
F   2
  1      0.5967918              0.0010494        
  2      0.1790687              0.0006468        
G   1
  1      1.0460130              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Be
data:
BERYLLIUM
S   7
  1    931.3932020              0.0339736        
  2    309.1384767              0.0769224        
  3    109.7579334              0.2770466        
  4     41.5609052              0.6423826        
  5     16.7186235              1.0888458        
  6      7.1095250              0.9162473        
  7      3.1768417              0.2832563        
S   1
  1      1.4810941              1.0000000        
S   1
  1      0.7146066              1.0000000        
S   1
  1      0.3536015              1.0000000        
S   1
  1      0.1776945              1.0000000        
S   1
  1      0.0897625              1.0000000        
P   2
  1      4.8768490              0.0006466        
  2      1.8686000              0.0169061        
P   1
  1      0.7059119              1.0000000        
P   1
  1      0.2644480              1.0000000        
P   1
  1      0.0987920              1.0000000        
D   2
  1      1.5703852              0.0036075        
  2      0.6733684              0.0208788        
D   1
  1      0.3299827              1.0000000        
D   1
  1      0.1697927              1.0000000        
F   2
  1      2.2794515             -0.0005539        
  2      0.9215384              0.0035407        
G   1
  1      1.3893341              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: B
data:
BORON
S   7
  1   1322.2016723              0.0542834        
  2    458.2370653              0.1167149        
  3    168.0023641              0.4020230        
  4     64.9577690              0.9377941        
  5     26.3871856              1.5869087        
  6     11.2108611              1.3566478        
  7      4.9554460              0.3199019        
S   1
  1      2.2652825              1.0000000        
S   1
  1      1.0638086              1.0000000        
S   1
  1      0.5095187              1.0000000        
S   1
  1      0.2469859              1.0000000        
S   1
  1      0.1202089              1.0000000        
P   2
  1      9.3560736             -0.0130117        
  2      3.9743131             -0.0114013        
P   1
  1      1.6645147              1.0000000        
P   1
  1      0.6913035              1.0000000        
P   1
  1      0.2863135              1.0000000        
D   2
  1      2.1120313              0.0228072        
  2      0.7780769              0.0405259        
D   1
  1      0.3277101              1.0000000        
D   1
  1      0.1449465              1.0000000        
F   2
  1      1.0582718              0.0087498        
  2      0.4010000              0.0036145        
G   1
  1      0.6514300              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: C
data:
CARBON
S   7
  1   1861.0916331              0.0744171        
  2    642.9939764              0.1653957        
  3    235.1105725              0.5576484        
  4     90.7028894              1.3108298        
  5     36.7794552              2.1694681        
  6     15.6046273              1.7668846        
  7      6.8907294              0.2930769        
S   1
  1      3.1478850              1.0000000        
S   1
  1      1.4777287              1.0000000        
S   1
  1      0.7076466              1.0000000        
S   1
  1      0.3430122              1.0000000        
S   1
  1      0.1669453              1.0000000        
P   2
  1     13.5472892             -0.0206477        
  2      5.4669419             -0.0115282        
P   1
  1      2.1751721              1.0000000        
P   1
  1      0.8582194              1.0000000        
P   1
  1      0.3376720              1.0000000        
D   2
  1      5.9287253             -0.0225948        
  2      1.9809209             -0.0476827        
D   1
  1      0.8055417              1.0000000        
D   1
  1      0.3531244              1.0000000        
F   2
  1      1.6755626              0.0088798        
  2      0.5997536              0.0069903        
G   1
  1      1.0024600              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: N
data:
NITROGEN
S   7
  1   2542.9401785              0.0904668        
  2   1029.5472946              0.1455675        
  3    424.9053546              0.4594090        
  4    178.4573708              1.1392859        
  5     76.1362742              2.1795891        
  6     32.9338653              2.7604305        
  7     14.4155436              1.2837451        
S   1
  1      6.3718891              1.0000000        
S   1
  1      2.8381742              1.0000000        
S   1
  1      1.2711793              1.0000000        
S   1
  1      0.5712407              1.0000000        
S   1
  1      0.2569887              1.0000000        
P   2
  1     17.8975990             -0.0330656        
  2      6.5346319              0.0041582        
P   1
  1      2.3523645              1.0000000        
P   1
  1      0.8397377              1.0000000        
P   1
  1      0.2989335              1.0000000        
D   2
  1      7.6909870              0.0035820        
  2      2.3044972              0.0180403        
D   1
  1      0.8403987              1.0000000        
D   1
  1      0.3303797              1.0000000        
F   2
  1      2.3331076              0.0067248        
  2      0.8446137              0.0054427        
G   1
  1      1.4037700              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: O
data:
OXYGEN
S   7
  1   2876.8216605              0.1443558        
  2   1004.7443032              0.2920041        
  3    369.7579954              1.0258517        
  4    142.9442404              2.2875516        
  5     57.8366425              3.6080237        
  6     24.3864983              2.3737865        
  7     10.6622662              0.0489414        
S   1
  1      4.8070437              1.0000000        
S   1
  1      2.2210770              1.0000000        
S   1
  1      1.0447795              1.0000000        
S   1
  1      0.4968425              1.0000000        
S   1
  1      0.2371384              1.0000000        
P   2
  1     64.2613382             -0.0126659        
  2     16.3006076             -0.0378744        
P   1
  1      4.3550542              1.0000000        
P   1
  1      1.2019554              1.0000000        
P   1
  1      0.3354196              1.0000000        
D   2
  1      9.2146611             -0.0597914        
  2      2.8435251             -0.0846724        
D   1
  1      0.9955759              1.0000000        
D   1
  1      0.3649441              1.0000000        
F   2
  1      2.6420115              1.0000000        
  2      0.7345613              1.0000000        
G   1
  1      1.3931000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: F
data:
FLUORINE
S   7
  1   3514.9201549              0.1805835        
  2   1231.2458815              0.3676084        
  3    454.1367336              1.2707881        
  4    175.8376258              2.8274164        
  5     71.2081775              4.3588226        
  6     30.0316883              2.7180994        
  7     13.1259023             -0.0804726        
S   1
  1      5.9126861              1.0000000        
S   1
  1      2.7284431              1.0000000        
S   1
  1      1.2813993              1.0000000        
S   1
  1      0.6082793              1.0000000        
S   1
  1      0.2897894              1.0000000        
P   2
  1     49.3740409             -0.0346332        
  2     13.4874956             -0.0096069        
P   1
  1      3.9664900              1.0000000        
P   1
  1      1.2226629              1.0000000        
P   1
  1      0.3830317              1.0000000        
D   2
  1     29.9719140             -0.0113316        
  2      6.7860915             -0.0467639        
D   1
  1      1.8137313              1.0000000        
D   1
  1      0.5157840              1.0000000        
F   2
  1      2.8301877              1.0000000        
  2      0.9155962              1.0000000        
G   1
  1      1.6097500              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ne
data:
NEON
S   7
  1   4165.3443917              0.2215380        
  2   1475.2326437              0.4503030        
  3    549.2884359              1.5166656        
  4    214.3631494              3.3680211        
  5     87.3657300              5.1165136        
  6     37.0296590              3.1485977        
  7     16.2441770             -0.1945455        
S   1
  1      7.3360628              1.0000000        
S   1
  1      3.3907965              1.0000000        
S   1
  1      1.5939747              1.0000000        
S   1
  1      0.7570527              1.0000000        
S   1
  1      0.3608023              1.0000000        
P   2
  1     61.2000000             -0.0346332        
  2     16.7000000             -0.0096069        
P   1
  1      4.9200000              1.0000000        
P   1
  1      1.5200000              1.0000000        
P   1
  1      0.4800000              1.0000000        
D   2
  1     37.1700000             -0.0113316        
  2      8.4100000             -0.0467639        
D   1
  1      2.2500000              1.0000000        
D   1
  1      0.6400000              1.0000000        
F   2
  1      3.5100000              1.0000000        
  2      1.1400000              1.0000000        
G   1
  1      2.0000000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Na
data:
SODIUM
S   7
  1   3754.9468758              0.3681280        
  2   1406.4560878              0.6386505        
  3    543.4611528              2.1314027        
  4    216.2389118              4.4341952        
  5     88.4180110              6.0193186        
  6     37.0700801              2.6066659        
  7     15.8976971             -0.6617046        
S   1
  1      6.9557845              1.0000000        
S   1
  1      3.0964156              1.0000000        
S   1
  1      1.3983233              1.0000000        
S   1
  1      0.6386578              1.0000000        
S   1
  1      0.2940844              1.0000000        
S   1
  1      0.1360866              1.0000000        
S   1
  1      0.0630775              1.0000000        
P   2
  1     19.2914768              0.0091163        
  2      5.8156595             -0.0286151        
P   1
  1      1.7285804              1.0000000        
P   1
  1      0.5094901              1.0000000        
P   1
  1      0.1497524              1.0000000        
D   2
  1     14.0911593              0.0025046        
  2      3.9826616              0.0012793        
D   1
  1      1.3285602              1.0000000        
D   1
  1      0.4969388              1.0000000        
D   1
  1      0.1937075              1.0000000        
F   2
  1      0.1873532              0.0012141        
  2      0.0980271             -0.0004706        
G   1
  1      0.0701600              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Mg
data:
MAGNESIUM
S   7
  1   4618.7144348              0.4062037        
  2   1715.8572368              0.7248204        
  3    660.3662172              2.4015050        
  4    262.7772421              5.0268089        
  5    107.8796646              6.8807535        
  6     45.5809298              3.0930185        
  7     19.7676678             -0.8061330        
S   1
  1      8.7738606              1.0000000        
S   1
  1      3.9730763              1.0000000        
S   1
  1      1.8294222              1.0000000        
S   1
  1      0.8535432              1.0000000        
S   1
  1      0.4020431              1.0000000        
S   1
  1      0.1904672              1.0000000        
S   1
  1      0.0904075              1.0000000        
P   2
  1      4.2335270             -0.0089796        
  2      1.3598327              0.0169486        
P   1
  1      0.5026752              1.0000000        
P   1
  1      0.2043109              1.0000000        
P   1
  1      0.0858908              1.0000000        
D   2
  1     15.3639340              0.0072298        
  2      3.9275269              0.0022521        
D   1
  1      1.1824901              1.0000000        
D   1
  1      0.3985299              1.0000000        
D   1
  1      0.1398822              1.0000000        
F   2
  1      2.2586461             -0.0009518        
  2      0.4740262              0.0022316        
G   1
  1      0.8087604              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Al
data:
ALUMINUM
S   7
  1   4875.9816108              0.5248525        
  2   1839.4838989              0.8958282        
  3    715.5582316              2.9427043        
  4    286.4958622              5.9976464        
  5    117.8265577              7.7609764        
  6     49.6666399              2.8641690        
  7     21.4066429             -1.0464290        
S   1
  1      9.4098725              1.0000000        
S   1
  1      4.2071557              1.0000000        
S   1
  1      1.9077330              1.0000000        
S   1
  1      0.8747225              1.0000000        
S   1
  1      0.4042979              1.0000000        
S   1
  1      0.1877731              1.0000000        
S   1
  1      0.0873510              1.0000000        
P   2
  1     10.9820947              0.0163880        
  2      3.3106913             -0.0029350        
P   1
  1      0.9840322              1.0000000        
P   1
  1      0.2900384              1.0000000        
P   1
  1      0.0852498              1.0000000        
D   3
  1     21.5501974              0.0114463        
  2      5.9277503              0.0082803        
  3      1.8822054             -0.0133523        
D   1
  1      0.6586442              1.0000000        
D   1
  1      0.2385982              1.0000000        
F   2
  1      0.5382976              0.0072119        
  2      0.1976728              0.0039371        
G   1
  1      0.3262000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Si
data:
SILICON
S   7
  1   5826.7657660              0.5677983        
  2   2173.1214409              1.0118069        
  3    839.4966509              3.2799844        
  4    335.2659622              6.7361713        
  5    138.1170978              8.6949143        
  6     58.5516054              3.2431556        
  7     25.4744274             -1.2520738        
S   1
  1     11.3418415              1.0000000        
S   1
  1      5.1513356              1.0000000        
S   1
  1      2.3788654              1.0000000        
S   1
  1      1.1130498              1.0000000        
S   1
  1      0.5257427              1.0000000        
S   1
  1      0.2497578              1.0000000        
S   1
  1      0.1188768              1.0000000        
P   2
  1      8.7836931              0.0242245        
  2      2.6158248             -0.0153268        
P   1
  1      0.8266040              1.0000000        
P   1
  1      0.2711487              1.0000000        
P   1
  1      0.0900870              1.0000000        
D   3
  1     10.8892767              0.0240593        
  2      2.6605925             -0.0189904        
  3      0.8067528              0.0242108        
D   1
  1      0.2859848              1.0000000        
D   1
  1      0.1074329              1.0000000        
F   2
  1      0.8103816              0.0088216        
  2      0.1988529              0.0020248        
G   1
  1      0.4014900              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: P
data:
PHOSPHOROUS
S   7
  1   7402.6405628              0.6312551        
  2   2444.3806296              1.0410015        
  3   1031.0485275              3.5177235        
  4    387.5215861              7.8577024        
  5    159.3342518              9.3323916        
  6     72.5438912              3.5808385        
  7     29.2976155             -1.1039880        
S   1
  1     13.1685047              1.0000000        
S   1
  1      6.4235268              1.0000000        
S   1
  1      3.1479365              1.0000000        
S   1
  1      1.4941282              1.0000000        
S   1
  1      0.6745215              1.0000000        
S   1
  1      0.3252877              1.0000000        
S   1
  1      0.1527285              1.0000000        
P   2
  1     10.6100703              0.0333958        
  2      3.3972489             -0.0239301        
P   1
  1      1.0821336              1.0000000        
P   1
  1      0.3436265              1.0000000        
P   1
  1      0.1090044              1.0000000        
D   3
  1      5.5575593              0.0066400        
  2      2.6033240             -0.0123559        
  3      1.2378589              0.0087029        
D   1
  1      0.5939646              1.0000000        
D   1
  1      0.2858732              1.0000000        
F   2
  1      1.0262041              0.0104661        
  2      0.2959414              0.0038742        
G   1
  1      0.5510844              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: S
data:
SULFUR
S   7
  1   7399.0303145              0.7227933        
  2   2710.1675859              1.3706745        
  3   1034.3279062              4.3217500        
  4    410.4645411              8.7624644        
  5    168.9762502             10.5289909        
  6     71.9687889              3.0836598        
  7     31.6172683             -1.5821203        
S   1
  1     14.2796836              1.0000000        
S   1
  1      6.6060948              1.0000000        
S   1
  1      3.1181477              1.0000000        
S   1
  1      1.4954039              1.0000000        
S   1
  1      0.7254779              1.0000000        
S   1
  1      0.3544216              1.0000000        
S   1
  1      0.1735525              1.0000000        
P   2
  1     12.6998799              0.0457971        
  2      4.4295784             -0.0394968        
P   1
  1      1.5232889              1.0000000        
P   1
  1      0.5194667              1.0000000        
P   1
  1      0.1766547              1.0000000        
D   3
  1     16.8546461              0.0263236        
  2      5.0810461             -0.0190773        
  3      1.5102323              0.0213668        
D   1
  1      0.4451331              1.0000000        
D   1
  1      0.1308362              1.0000000        
F   2
  1      1.0809860              1.0000000        
  2      0.4161474              1.0000000        
G   1
  1      0.6707100              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Cl
data:
CHLORINE
S   7
  1   8044.2766240              0.8306605        
  2   2924.5123954              1.6146203        
  3   1110.8168739              5.0051398        
  4    439.9050761              9.9863273        
  5    181.1987287             11.3443970        
  6     77.4148302              2.6726629        
  7     34.1977273             -1.6043227        
S   1
  1     15.5648397              1.0000000        
S   1
  1      7.2707873              1.0000000        
S   1
  1      3.4711900              1.0000000        
S   1
  1      1.6860808              1.0000000        
S   1
  1      0.8293125              1.0000000        
S   1
  1      0.4110124              1.0000000        
S   1
  1      0.2042190              1.0000000        
P   2
  1     12.2564993              0.0563086        
  2      4.8922575             -0.0563007        
P   1
  1      1.9265460              1.0000000        
P   1
  1      0.7525989              1.0000000        
P   1
  1      0.2932189              1.0000000        
D   3
  1     28.4370504             -0.0265404        
  2      7.2772298              0.0134848        
  3      2.3111621             -0.0136452        
D   1
  1      0.8580943              1.0000000        
D   1
  1      0.3376227              1.0000000        
F   2
  1      1.2035685              1.0000000        
  2      0.4700000              1.0000000        
G   1
  1      0.7521100              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ar
data:
ARGON
S   7
  1   9188.5309157              0.8877141        
  2   3279.0428273              1.8231585        
  3   1227.6297914              5.6127323        
  4    481.1823792             11.2156190        
  5    196.9697695             12.2962961        
  6     83.9606192              2.3552090        
  7     37.1435409             -1.5769042        
S   1
  1     16.9892190              1.0000000        
S   1
  1      8.0003093              1.0000000        
S   1
  1      3.8606959              1.0000000        
S   1
  1      1.8996439              1.0000000        
S   1
  1      0.9480149              1.0000000        
S   1
  1      0.4771798              1.0000000        
S   1
  1      0.2408781              1.0000000        
P   2
  1     14.1000000              0.0563086        
  2      5.6300000             -0.0563007        
P   1
  1      2.2200000              1.0000000        
P   1
  1      0.8700000              1.0000000        
P   1
  1      0.3400000              1.0000000        
D   3
  1     32.7000000             -0.0265404        
  2      8.3700000              0.0134848        
  3      2.6600000             -0.0136452        
D   1
  1      0.9900000              1.0000000        
D   1
  1      0.3900000              1.0000000        
F   2
  1      1.3800000              1.0000000        
  2      0.5400000              1.0000000        
G   1
  1      0.8700000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: K
data:
POTASSIUM
S   12
  1  15600.4998000              0.6051572        
  2   6840.8316412              0.5813049        
  3   3055.5125810              2.2844173        
  4   1389.0430931              4.7624289        
  5    642.1465666              9.1248263        
  6    301.6119674             12.2016392        
  7    143.7961476              7.5846370        
  8     69.5181492             -0.9813327        
  9     34.0447209              0.1827059        
 10     16.8706410              8.6437278        
 11      8.4499772              5.8265076        
 12      4.2728448             -1.6665361        
S   1
  1      2.1786969              1.0000000        
S   1
  1      1.1188238              1.0000000        
S   1
  1      0.5779194              1.0000000        
S   1
  1      0.2998881              1.0000000        
S   1
  1      0.1561261              1.0000000        
S   1
  1      0.0814421              1.0000000        
S   1
  1      0.0425117              1.0000000        
P   2
  1     35.0867756             -0.0129960        
  2      8.2256301              0.0042675        
P   1
  1      1.9013059              1.0000000        
P   1
  1      0.4358032              1.0000000        
P   1
  1      0.0996141              1.0000000        
D   2
  1      4.3574288              0.0014449        
  2      1.4555147             -0.0021214        
D   1
  1      0.4793580              1.0000000        
D   1
  1      0.1565521              1.0000000        
D   1
  1      0.0509859              1.0000000        
F   3
  1      2.2961175             -0.0019497        
  2      0.6766476             -0.0019950        
  3      0.1981564              0.0021994        
G   1
  1      0.2814606              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ca
data:
CALCIUM
S   12
  1  17917.6370280              0.6831653        
  2   8061.4596925              0.3918308        
  3   3601.3424667              2.6391299        
  4   1620.0122645              4.3734240        
  5    778.4284854              9.5722795        
  6    357.7554238             13.1715185        
  7    172.7026048              8.9978572        
  8     84.9193850             -0.4545484        
  9     41.0281476             -0.4987409        
 10     20.1494249              9.2079374        
 11     10.2489427              7.2301219        
 12      5.0555149             -1.9039492        
S   1
  1      2.6223894              1.0000000        
S   1
  1      1.3458864              1.0000000        
S   1
  1      0.6963381              1.0000000        
S   1
  1      0.3565069              1.0000000        
S   1
  1      0.1853829              1.0000000        
S   1
  1      0.0975465              1.0000000        
S   1
  1      0.0508517              1.0000000        
P   2
  1     12.5452782             -0.0060069        
  2      3.5025409             -0.0066064        
P   1
  1      1.0011018              1.0000000        
P   1
  1      0.2902721              1.0000000        
P   1
  1      0.0845726              1.0000000        
D   2
  1      9.5006987              0.0012657        
  2      3.0210015              0.0029405        
D   1
  1      0.9763668              1.0000000        
D   1
  1      0.3186918              1.0000000        
D   1
  1      0.1043687              1.0000000        
F   3
  1      2.4531931             -0.0083306        
  2      0.7229365             -0.0006437        
  3      0.2117121              0.0021253        
G   1
  1      0.9854875              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Sc
data:
SCANDIUM
S   12
  1  98612.7465040              0.2881537        
  2   7210.3125501              3.0971477        
  3   4075.8639445             -3.0468547        
  4   2501.5115273              7.8667177        
  5    846.2830005             10.7908312        
  6    497.8135157              6.5247306        
  7    298.0167777             11.8190682        
  8    162.6523616              5.8011585        
  9     59.6033884             -1.9154412        
 10     35.0608157              2.5873650        
 11     20.6240087              8.5944447        
 12     12.1317695              6.9837735        
S   1
  1      4.4902120              1.0000000        
S   1
  1      2.4506794              1.0000000        
S   1
  1      1.4817371              1.0000000        
S   1
  1      0.8376001              1.0000000        
S   1
  1      0.1765263              1.0000000        
S   1
  1      0.0997872              1.0000000        
S   1
  1      0.0606353              1.0000000        
P   1
  1     10.8099871              1.0000000        
P   1
  1      3.2058514              1.0000000        
P   1
  1      0.9739254              1.0000000        
P   1
  1      0.3002684              1.0000000        
P   1
  1      0.0930355              1.0000000        
D   1
  1     15.0102726              1.0000000        
D   1
  1      4.2489449              1.0000000        
D   1
  1      1.2496854              1.0000000        
D   1
  1      0.3763665              1.0000000        
D   1
  1      0.1142632              1.0000000        
F   2
  1      3.3095160             -0.0030594        
  2      1.7054297             -0.0127954        
F   1
  1      0.8769316              1.0000000        
G   1
  1      5.4407205              1.0000000        
G   1
  1      1.7246112              1.0000000        
G   1
  1      0.5581653              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ti
data:
TITANIUM
S   12
  1  19204.6235570              0.9150506        
  2   8781.0703955              0.4699773        
  3   4148.7833952              3.0298523        
  4   1906.8876382              5.4371020        
  5    908.9650422             11.0298634        
  6    431.5745483             14.8132612        
  7    211.1642070             10.3626783        
  8    102.2548133             -0.5837071        
  9     50.7017530             -0.6326340        
 10     25.0892871             11.5043968        
 11     12.7562921              8.4908452        
 12      6.3986226             -3.0065313        
S   1
  1      3.2036391              1.0000000        
S   1
  1      1.6645345              1.0000000        
S   1
  1      0.8426907              1.0000000        
S   1
  1      0.4321995              1.0000000        
S   1
  1      0.2216023              1.0000000        
S   1
  1      0.1143336              1.0000000        
S   1
  1      0.0588697              1.0000000        
P   1
  1     16.7078840              1.0000000        
P   1
  1      4.4154511              1.0000000        
P   1
  1      1.2395226              1.0000000        
P   1
  1      0.3614638              1.0000000        
P   1
  1      0.1067894              1.0000000        
D   1
  1     10.7607651              1.0000000        
D   1
  1      3.6392680              1.0000000        
D   1
  1      1.3695124              1.0000000        
D   1
  1      0.5931772              1.0000000        
D   1
  1      0.2569230              1.0000000        
F   2
  1      3.1724794             -0.0155587        
  2      1.1137039             -0.0010250        
F   1
  1      0.3885240              1.0000000        
G   1
  1      6.9650158              1.0000000        
G   1
  1      2.1773896              1.0000000        
G   1
  1      0.6876369              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: V
data:
VANADIUM
S   12
  1  11942.0842430              2.3430425        
  2   2430.7110193              8.8888994        
  3    841.0764301             14.7776882        
  4    494.7508273              7.1901959        
  5    291.0298903             13.5563769        
  6    171.1940483              2.2742542        
  7     59.2366916             -2.0798226        
  8     34.8451117              7.1058855        
  9     20.4971240             11.0294860        
 10     12.0571314              4.4034789        
 11      7.0924300             -2.8965426        
 12      4.1720176             -0.6430604        
S   1
  1      2.4541279              1.0000000        
S   1
  1      1.4436046              1.0000000        
S   1
  1      0.8491792              1.0000000        
S   1
  1      0.2938336              1.0000000        
S   1
  1      0.1728433              1.0000000        
S   1
  1      0.1016725              1.0000000        
S   1
  1      0.0598074              1.0000000        
P   1
  1     16.7130979              1.0000000        
P   1
  1      4.7454037              1.0000000        
P   1
  1      1.3889998              1.0000000        
P   1
  1      0.4142440              1.0000000        
P   1
  1      0.1243234              1.0000000        
D   1
  1      7.7143225              1.0000000        
D   1
  1      3.1170731              1.0000000        
D   1
  1      1.2767950              1.0000000        
D   1
  1      0.5273386              1.0000000        
D   1
  1      0.2184050              1.0000000        
F   2
  1      3.1309344             -0.0188627        
  2      1.0419780              0.0031524        
F   1
  1      0.3559044              1.0000000        
G   1
  1      8.7130110              1.0000000        
G   1
  1      2.7493872              1.0000000        
G   1
  1      0.8775089              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Cr
data:
CHROMIUM
S   12
  1  22068.3284240              1.2311186        
  2  10310.8895880             -0.1803545        
  3   5874.1996884              3.0996748        
  4   3056.7316460              3.3857089        
  5   1578.4919380              8.9414617        
  6    809.3861699             12.2195628        
  7    438.3568734             15.0612186        
  8    220.5886040              9.9023470        
  9    115.7826755             -2.5664082        
 10     50.5886272              2.0386762        
 11     26.0501639             15.6667257        
 12     13.2120964              5.6715887        
S   1
  1      7.0565191              1.0000000        
S   1
  1      3.2438287              1.0000000        
S   1
  1      1.6625711              1.0000000        
S   1
  1      0.7341156              1.0000000        
S   1
  1      0.3736963              1.0000000        
S   1
  1      0.1924875              1.0000000        
S   1
  1      0.0837506              1.0000000        
P   1
  1     19.1759031              1.0000000        
P   1
  1      4.7052443              1.0000000        
P   1
  1      1.2925721              1.0000000        
P   1
  1      0.3825208              1.0000000        
P   1
  1      0.1161954              1.0000000        
D   1
  1     31.2759498              1.0000000        
D   1
  1      7.1528914              1.0000000        
D   1
  1      1.8136115              1.0000000        
D   1
  1      0.4919052              1.0000000        
D   1
  1      0.1365942              1.0000000        
F   2
  1      2.8679160             -0.0195047        
  2      0.5851052              0.0115724        
F   1
  1      0.1339202              1.0000000        
G   1
  1     12.4142739              1.0000000        
G   1
  1      4.4448953              1.0000000        
G   1
  1      1.6427198              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Mn
data:
MANGANESE
S   12
  1  17733.2246460              2.0292530        
  2   3609.4490442              7.9031521        
  3   1299.6563311             12.7657954        
  4    749.4399737             10.3339893        
  5    440.8470310             14.0664479        
  6    254.2121170              8.7966524        
  7     89.7307132             -2.0086132        
  8     52.7827710              2.3261543        
  9     31.6727660             13.1659295        
 10     17.9040623             10.1098077        
 11     10.7434900             -2.4278177        
 12      6.3196998             -2.1609521        
S   1
  1      3.7921915              1.0000000        
S   1
  1      2.2307008              1.0000000        
S   1
  1      1.2609763              1.0000000        
S   1
  1      0.7417507              1.0000000        
S   1
  1      0.2670826              1.0000000        
S   1
  1      0.1540118              1.0000000        
S   1
  1      0.0905952              1.0000000        
P   1
  1      2.7199275              1.0000000        
P   1
  1      1.1743733              1.0000000        
P   1
  1      0.5068762              1.0000000        
P   1
  1      0.2187287              1.0000000        
P   1
  1      0.0943798              1.0000000        
D   1
  1     11.5225001              1.0000000        
D   1
  1      3.7793049              1.0000000        
D   1
  1      1.2528632              1.0000000        
D   1
  1      0.4180182              1.0000000        
D   1
  1      0.1397732              1.0000000        
F   2
  1      6.9646522             -0.0024120        
  2      2.4170922             -0.0049219        
F   1
  1      0.8415789              1.0000000        
G   1
  1      5.9366152              1.0000000        
G   1
  1      1.4312160              1.0000000        
G   1
  1      0.3465192              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Fe
data:
IRON
S   12
  1  22231.1675350              1.5463792        
  2  10088.6252560              0.5616730        
  3   4961.4420234              4.8306560        
  4   2333.9778892              7.2162778        
  5   1195.0581566             13.7667481        
  6    605.7548994             17.3953035        
  7    312.9849847             13.5974545        
  8    146.2270422             -0.1052884        
  9     73.1574429             -1.5186939        
 10     37.1905224             16.4954218        
 11     18.7270618             11.2685887        
 12      9.8648356             -5.1127291        
S   1
  1      4.9921254              1.0000000        
S   1
  1      2.5312760              1.0000000        
S   1
  1      1.2321766              1.0000000        
S   1
  1      0.6265715              1.0000000        
S   1
  1      0.3212932              1.0000000        
S   1
  1      0.1627967              1.0000000        
S   1
  1      0.0808724              1.0000000        
P   1
  1     19.0489263              1.0000000        
P   1
  1      5.1364325              1.0000000        
P   1
  1      1.3971534              1.0000000        
P   1
  1      0.3820476              1.0000000        
P   1
  1      0.1046543              1.0000000        
D   1
  1     13.4494385              1.0000000        
D   1
  1      4.6650265              1.0000000        
D   1
  1      1.5953692              1.0000000        
D   1
  1      0.5410331              1.0000000        
D   1
  1      0.1829694              1.0000000        
F   2
  1      4.4300720             -0.0066965        
  2      0.6208564              0.0038112        
F   1
  1      0.0884909              1.0000000        
G   1
  1     11.9744409              1.0000000        
G   1
  1      3.6312678              1.0000000        
G   1
  1      1.0943052              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Co
data:
COBALT
S   12
  1  22984.7412470              1.8791745        
  2  11624.1099270             -0.1009719        
  3   5640.3127898              5.4867635        
  4   2645.0376429              6.3829372        
  5   1371.0418944             15.3176605        
  6    651.5910470             19.3841517        
  7    339.5908122             13.7760601        
  8    160.5957974              0.4301535        
  9     80.4014754             -2.4807282        
 10     42.1316835             17.1669735        
 11     21.1733240             12.7549558        
 12     10.6983797             -5.3364495        
S   1
  1      5.3718887              1.0000000        
S   1
  1      2.7108298              1.0000000        
S   1
  1      1.3406445              1.0000000        
S   1
  1      0.6844781              1.0000000        
S   1
  1      0.3500673              1.0000000        
S   1
  1      0.1771067              1.0000000        
S   1
  1      0.0899548              1.0000000        
P   1
  1      2.4895098              1.0000000        
P   1
  1      1.1178371              1.0000000        
P   1
  1      0.5057605              1.0000000        
P   1
  1      0.2298817              1.0000000        
P   1
  1      0.1046479              1.0000000        
D   1
  1     39.1009947              1.0000000        
D   1
  1     13.4136581              1.0000000        
D   1
  1      4.5931057              1.0000000        
D   1
  1      1.5710363              1.0000000        
D   1
  1      0.5371633              1.0000000        
F   2
  1      6.3589028             -0.0139407        
  2      1.8418252             -0.0015213        
F   1
  1      0.5359683              1.0000000        
G   1
  1     18.1954609              1.0000000        
G   1
  1      6.0833764              1.0000000        
G   1
  1      2.0211729              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ni
data:
NICKEL
S   12
  1  22563.9787840              2.3471633        
  2   4592.7085051              9.4929055        
  3   1589.1724040             16.2456582        
  4    934.8072702             11.2020312        
  5    549.8866141             16.9261542        
  6    323.4627051             10.1481287        
  7    111.9248052             -2.8026798        
  8     65.8381188              4.5460584        
  9     38.7283041             16.3485067        
 10     22.7813547             10.6984945        
 11     13.4007965             -3.9670080        
 12      7.8828213             -1.7808478        
S   1
  1      4.6369536              1.0000000        
S   1
  1      2.7276197              1.0000000        
S   1
  1      1.6044821              1.0000000        
S   1
  1      0.9438130              1.0000000        
S   1
  1      0.5551841              1.0000000        
S   1
  1      0.3265789              1.0000000        
S   1
  1      0.1130031              1.0000000        
P   1
  1      3.1875428              1.0000000        
P   1
  1      1.2896458              1.0000000        
P   1
  1      0.5289442              1.0000000        
P   1
  1      0.2187477              1.0000000        
P   1
  1      0.0907155              1.0000000        
D   1
  1      9.7032658              1.0000000        
D   1
  1      3.9764688              1.0000000        
D   1
  1      1.6295856              1.0000000        
D   1
  1      0.6723272              1.0000000        
D   1
  1      0.2785147              1.0000000        
F   2
  1      2.2394071             -0.0066692        
  2      0.6523378              0.0083570        
F   1
  1      0.1910373              1.0000000        
G   1
  1     15.9627506              1.0000000        
G   1
  1      5.1321451              1.0000000        
G   1
  1      1.6619205              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Cu
data:
COPPER
S   12
  1  22760.1575320              2.0757355        
  2   7272.8802874              5.0748858        
  3   2725.0817134             12.1893535        
  4   1480.3337422             10.7340332        
  5    870.7845298             16.9779033        
  6    533.0245964             14.5404854        
  7    313.5438715              8.6537292        
  8    112.8979167             -4.1810761        
  9     66.4105374              8.1507841        
 10     39.0650209             16.8724469        
 11     22.9794234              9.7250596        
 12     13.5173075             -5.7359384        
S   1
  1      4.3193796              1.0000000        
S   1
  1      2.5408114              1.0000000        
S   1
  1      1.5552814              1.0000000        
S   1
  1      0.9148714              1.0000000        
S   1
  1      0.3294183              1.0000000        
S   1
  1      0.1139855              1.0000000        
S   1
  1      0.0670503              1.0000000        
P   1
  1     10.4327236              1.0000000        
P   1
  1      4.0251086              1.0000000        
P   1
  1      1.5534382              1.0000000        
P   1
  1      0.5996423              1.0000000        
P   1
  1      0.2314823              1.0000000        
D   2
  1     19.6140080             -0.0211366        
  2      7.2975860              0.0263009        
D   1
  1      2.7500946              1.0000000        
D   1
  1      1.0444408              1.0000000        
D   1
  1      0.3976934              1.0000000        
F   1
  1      5.8169042              1.0000000        
F   1
  1      0.7156542              1.0000000        
F   1
  1      0.0892019              1.0000000        
G   1
  1     15.3794722              1.0000000        
G   1
  1      4.2631148              1.0000000        
G   1
  1      1.1926492              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Zn
data:
ZINC
S   12
  1  30551.9544690              2.1427401        
  2   6218.5939138              8.8047088        
  3   2151.7624792             16.0008682        
  4   1265.7425993             11.2584053        
  5    744.5544493             19.5302706        
  6    437.9731932             13.5622422        
  7    257.6312829              3.0481957        
  8    151.5478092             -2.5872090        
  9     52.4386854             17.8287839        
 10     30.8462846             14.3096651        
 11     10.6734543             -5.5459298        
 12      6.2785024              4.7543194        
S   1
  1      3.6932366              1.0000000        
S   1
  1      2.1724920              1.0000000        
S   1
  1      1.2779365              1.0000000        
S   1
  1      0.7517273              1.0000000        
S   1
  1      0.2601132              1.0000000        
S   1
  1      0.1530078              1.0000000        
S   1
  1      0.0900046              1.0000000        
P   1
  1      3.2312922              1.0000000        
P   1
  1      1.3537231              1.0000000        
P   1
  1      0.5635201              1.0000000        
P   1
  1      0.2336862              1.0000000        
P   1
  1      0.0967846              1.0000000        
D   1
  1     15.2191565              1.0000000        
D   1
  1      5.1494048              1.0000000        
D   1
  1      1.7418300              1.0000000        
D   1
  1      0.5890930              1.0000000        
D   1
  1      0.1992225              1.0000000        
F   2
  1      6.3320732              0.0043183        
  2      2.2893036             -0.0028012        
F   1
  1      0.8347658              1.0000000        
G   1
  1     13.7400089              1.0000000        
G   1
  1      3.3877103              1.0000000        
G   1
  1      0.8352674              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ga
data:
GALLIUM
S   12
  1  22118.8686370              3.6312148        
  2  11563.1894470             -1.1372003        
  3   6066.9073717              8.7100393        
  4   3064.1629886              7.9912451        
  5   1582.3294729             20.7576561        
  6    785.5319670             22.0229881        
  7    420.5746558             15.8971216        
  8    218.3678189             -1.8721945        
  9    107.8151898             -0.1109626        
 10     51.4202463             24.3297099        
 11     27.1061684             10.8281431        
 12     13.4767963             -7.2300603        
S   1
  1      6.6121251              1.0000000        
S   1
  1      3.3168950              1.0000000        
S   1
  1      1.5368355              1.0000000        
S   1
  1      0.8029702              1.0000000        
S   1
  1      0.3746460              1.0000000        
S   1
  1      0.1924527              1.0000000        
S   1
  1      0.0894794              1.0000000        
P   2
  1      6.4816513              1.0000000        
  2      1.9990599              1.0000000        
P   1
  1      0.6508461              1.0000000        
P   1
  1      0.2192172              1.0000000        
P   1
  1      0.0746963              1.0000000        
D   3
  1     23.3115125             -0.0026250        
  2      6.5778878              0.0200621        
  3      1.8734606             -0.0169174        
D   1
  1      0.5365944              1.0000000        
D   1
  1      0.1539803              1.0000000        
F   2
  1      2.0365377             -0.0012599        
  2      0.5063106              0.0032855        
F   1
  1      0.1257500              1.0000000        
G   1
  1      0.9825567              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ge
data:
GERMANIUM
S   12
  1  28796.4428680              2.8646544        
  2  14646.9616880             -0.4061824        
  3   7471.7899835              7.2992336        
  4   3895.3057027              7.0744512        
  5   2011.5304056             18.8178893        
  6   1021.2184280             22.5492061        
  7    530.7010175             21.3994917        
  8    255.3655914              1.6377927        
  9    131.8672763             -3.2635898        
 10     62.5282421             21.6195717        
 11     33.3202533             17.5304788        
 12     16.2383651             -7.4182512        
S   1
  1      7.8587116              1.0000000        
S   1
  1      4.2116039              1.0000000        
S   1
  1      2.0601257              1.0000000        
S   1
  1      1.0018843              1.0000000        
S   1
  1      0.4972238              1.0000000        
S   1
  1      0.2356806              1.0000000        
S   1
  1      0.1116319              1.0000000        
P   2
  1      7.6822072              1.0000000        
  2      2.4152641              1.0000000        
P   1
  1      0.7834626              1.0000000        
P   1
  1      0.2590749              1.0000000        
P   1
  1      0.0862290              1.0000000        
D   3
  1      6.0738920             -0.0201057        
  2      1.9956548              0.0227678        
  3      0.7038653             -0.0238263        
D   1
  1      0.2596990              1.0000000        
D   1
  1      0.0973145              1.0000000        
F   2
  1      2.4274828             -0.0023660        
  2      0.7006729              0.0061731        
F   1
  1      0.2019000              1.0000000        
G   1
  1      0.8994605              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: As
data:
ARSENIC
S   12
  1  26349.9022630              3.0537145        
  2   9117.6127284              5.5690714        
  3   3154.8831200             22.1466660        
  4   1091.6549976             35.2107294        
  5    642.1499806              6.7189378        
  6    377.7352721             16.8044997        
  7    222.1972126             -7.5350959        
  8     76.8848444             13.2913279        
  9     45.2263778             23.1205976        
 10     26.6037509              3.5902044        
 11     15.6492648             -7.8992726        
 12      9.2054496              3.3276883        
S   1
  1      5.4149702              1.0000000        
S   1
  1      3.1852765              1.0000000        
S   1
  1      1.8736920              1.0000000        
S   1
  1      0.6483363              1.0000000        
S   1
  1      0.3813743              1.0000000        
S   1
  1      0.2243378              1.0000000        
S   1
  1      0.1319634              1.0000000        
P   2
  1      7.2637315              0.0100015        
  2      2.4151705             -0.0279590        
P   1
  1      0.8192826              1.0000000        
P   1
  1      0.2813347              1.0000000        
P   1
  1      0.0970052              1.0000000        
D   3
  1     22.8613405             -0.0028615        
  2      7.4219103              0.0114491        
  3      2.4809102             -0.0120303        
D   1
  1      0.8443001              1.0000000        
D   1
  1      0.2890752              1.0000000        
F   2
  1      2.8008427             -0.0029300        
  2      0.9558538              0.0064388        
F   1
  1      0.3262074              1.0000000        
G   1
  1      0.8920726              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Se
data:
SELENIUM
S   12
  1 182587.1093200              0.7871683        
  2  20799.6860920              2.8434576        
  3  10963.6341210              4.8057763        
  4   3793.6448116             18.7809406        
  5   1539.6773146             26.6954015        
  6    836.2676977             20.3863962        
  7    491.9221613             15.1527499        
  8    176.2716372             -3.8835832        
  9    100.1266273              5.9543421        
 10     58.8980144             26.3213790        
 11     33.4555214             11.6714825        
 12     19.0063819             -8.6271219        
S   1
  1      7.0518801              1.0000000        
S   1
  1      4.1481646              1.0000000        
S   1
  1      2.3920173              1.0000000        
S   1
  1      0.8443241              1.0000000        
S   1
  1      0.4966612              1.0000000        
S   1
  1      0.2821158              1.0000000        
S   1
  1      0.1602725              1.0000000        
P   2
  1      8.7516826              0.0107828        
  2      2.8944407             -0.0295335        
P   1
  1      0.9766426              1.0000000        
P   1
  1      0.3335879              1.0000000        
P   1
  1      0.1144109              1.0000000        
D   3
  1      7.8807486             -0.0168739        
  2      2.6611416              0.0192822        
  3      0.9250344             -0.0220267        
D   1
  1      0.3273259              1.0000000        
D   1
  1      0.1165229              1.0000000        
F   2
  1      3.0536409             -0.0031967        
  2      0.8481417              0.0110377        
F   1
  1      0.2355400              1.0000000        
G   1
  1      0.9616190              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Br
data:
BROMINE
S   12
  1 181929.6907400              0.9703820        
  2  21782.5062350              3.1341819        
  3   7843.2391724             11.0443801        
  4   2608.0271777             24.6916778        
  5   1564.9696465             12.3123948        
  6    920.5703545             24.6284398        
  7    552.3963380             16.2668646        
  8    191.1405907             -3.1865943        
  9    108.0484426              5.1797612        
 10     64.8354183             25.8419691        
 11     38.1384803             15.5771030        
 12     22.4343995             -9.1953776        
S   1
  1     13.1967052              1.0000000        
S   1
  1      7.9187991              1.0000000        
S   1
  1      4.6581170              1.0000000        
S   1
  1      2.6331523              1.0000000        
S   1
  1      0.5577180              1.0000000        
S   1
  1      0.3152683              1.0000000        
S   1
  1      0.1854519              1.0000000        
P   2
  1      8.4481854              0.0134690        
  2      3.0812881             -0.0389777        
P   1
  1      1.1536778              1.0000000        
P   1
  1      0.4389478              1.0000000        
P   1
  1      0.1679158              1.0000000        
D   3
  1      8.7933629             -0.0194411        
  2      3.5598266              0.0201204        
  3      1.4866514             -0.0158267        
D   1
  1      0.6328484              1.0000000        
D   1
  1      0.2711415              1.0000000        
F   2
  1      3.4681858             -0.0029576        
  2      0.8708007              0.0124094        
F   1
  1      0.2186427              1.0000000        
G   1
  1      1.1078575              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Kr
data:
KRYPTON
S   12
  1  25124.7655573              5.4122684        
  2   5113.9351604             23.8184381        
  3   3008.1970688             -8.4029924        
  4   1769.5276379             45.6087554        
  5    612.2932660             36.4135060        
  6    360.1724993             -9.8041476        
  7    211.8661701              2.6373869        
  8    124.6271554             -0.1448996        
  9     73.3100894             27.9730114        
 10     43.1235808             18.4639348        
 11     25.3668115             -8.3616758        
 12     14.9216534             -3.2585745        
S   1
  1      8.7774429              1.0000000        
S   1
  1      5.1632016              1.0000000        
S   1
  1      3.0371773              1.0000000        
S   1
  1      1.0509263              1.0000000        
S   1
  1      0.6181920              1.0000000        
S   1
  1      0.3636423              1.0000000        
S   1
  1      0.2139072              1.0000000        
P   2
  1      9.7200000              0.0134690        
  2      3.5400000             -0.0389777        
P   1
  1      1.3300000              1.0000000        
P   1
  1      0.5000000              1.0000000        
P   1
  1      0.1900000              1.0000000        
D   3
  1     10.1100000             -0.0194411        
  2      4.0900000              0.0201204        
  3      1.7100000             -0.0158267        
D   1
  1      0.7300000              1.0000000        
D   1
  1      0.3100000              1.0000000        
F   2
  1      3.9900000             -0.0029576        
  2      1.0000000              0.0124094        
F   1
  1      0.2500000              1.0000000        
G   1
  1      1.2700000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Rb
data:
RUBIDIUM
S   4
  1     14.8277116              0.0608401        
  2      8.7221830             -0.4741652        
  3      5.1306958              1.5852121        
  4      3.0180562             -1.8427056        
S   1
  1      1.7753272              1.0000000        
S   1
  1      1.0443101              1.0000000        
S   1
  1      0.6143000              1.0000000        
S   1
  1      0.3613529              1.0000000        
S   1
  1      0.0735504              1.0000000        
S   1
  1      0.0432649              1.0000000        
S   1
  1      0.0254499              1.0000000        
P   2
  1      3.0726016              0.0090140        
  2      1.1369353             -0.0358530        
P   1
  1      0.4569368              1.0000000        
P   1
  1      0.1936542              1.0000000        
P   1
  1      0.0835914              1.0000000        
D   2
  1      1.3411819              0.0009034        
  2      0.4379095             -0.0071483        
D   1
  1      0.1567271              1.0000000        
D   1
  1      0.0595258              1.0000000        
D   1
  1      0.0230791              1.0000000        
F   3
  1      0.8445587             -0.0026174        
  2      0.3153454             -0.0002409        
  3      0.1184513              0.0017392        
G   1
  1      0.1808175              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Sr
data:
STRONTIUM
S   4
  1     31.8879343              0.0098846        
  2      9.4301300             -0.4292237        
  3      5.6307588              1.8718426        
  4      3.3787864             -2.2401775        
S   1
  1      1.9875213              1.0000000        
S   1
  1      1.1926297              1.0000000        
S   1
  1      0.6877236              1.0000000        
S   1
  1      0.4045433              1.0000000        
S   1
  1      0.1399804              1.0000000        
S   1
  1      0.0823414              1.0000000        
S   1
  1      0.0416009              1.0000000        
P   2
  1      1.2481443             -0.0208349        
  2      0.6134265              0.0441633        
P   1
  1      0.2972469              1.0000000        
P   1
  1      0.1428327              1.0000000        
P   1
  1      0.0684432              1.0000000        
D   2
  1      6.8818940             -0.0017912        
  2      2.2949967              0.0041742        
D   1
  1      0.7554207              1.0000000        
D   1
  1      0.2467349              1.0000000        
D   1
  1      0.0803815              1.0000000        
F   3
  1      1.1408701             -0.0079217        
  2      0.3641675              0.0018987        
  3      0.1173184              0.0014617        
G   1
  1      0.5831166              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Y
data:
YTTRIUM
S   4
  1     18.4228114              0.0772748        
  2     10.8369476             -0.6623447        
  3      6.3746749              2.2907103        
  4      3.7498086             -2.6367675        
S   1
  1      2.2278274              1.0000000        
S   1
  1      1.3104867              1.0000000        
S   1
  1      0.7632421              1.0000000        
S   1
  1      0.4489659              1.0000000        
S   1
  1      0.1569050              1.0000000        
S   1
  1      0.0922971              1.0000000        
S   1
  1      0.0537548              1.0000000        
P   1
  1      1.9203007              1.0000000        
P   1
  1      0.7990992              1.0000000        
P   1
  1      0.3478309              1.0000000        
P   1
  1      0.1557017              1.0000000        
P   1
  1      0.0703636              1.0000000        
D   1
  1      5.7534743              1.0000000        
D   1
  1      1.5794103              1.0000000        
D   1
  1      0.5341157              1.0000000        
D   1
  1      0.2098183              1.0000000        
D   1
  1      0.0871171              1.0000000        
F   2
  1      1.4562045             -0.0211924        
  2      0.4296594              0.0072121        
F   1
  1      0.1278076              1.0000000        
G   1
  1      1.2949792              1.0000000        
G   1
  1      0.3816201              1.0000000        
G   1
  1      0.1117575              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Zr
data:
ZIRCONIUM
S   4
  1     31.9496472              0.0195674        
  2     11.3910710             -0.5829896        
  3      6.7006298              2.5436590        
  4      3.9415468             -3.3335860        
S   1
  1      2.2841235              1.0000000        
S   1
  1      1.3981576              1.0000000        
S   1
  1      0.8224456              1.0000000        
S   1
  1      0.4580096              1.0000000        
S   1
  1      0.1716120              1.0000000        
S   1
  1      0.0984717              1.0000000        
S   1
  1      0.0579245              1.0000000        
P   1
  1      4.1403511              1.0000000        
P   1
  1      1.8165899              1.0000000        
P   1
  1      0.7885726              1.0000000        
P   1
  1      0.3401489              1.0000000        
P   1
  1      0.1464135              1.0000000        
D   1
  1      2.3340737              1.0000000        
D   1
  1      1.0436609              1.0000000        
D   1
  1      0.4601097              1.0000000        
D   1
  1      0.2011495              1.0000000        
D   1
  1      0.0876937              1.0000000        
F   2
  1      1.3813732             -0.0193482        
  2      0.4572625              0.0096168        
F   1
  1      0.1536990              1.0000000        
G   1
  1      1.7041213              1.0000000        
G   1
  1      0.6942669              1.0000000        
G   1
  1      0.2810797              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Nb
data:
NIOBIUM
S   4
  1     23.6097510              0.0912480        
  2     12.9971517             -0.8368562        
  3      7.6453831              2.7528925        
  4      4.2087782             -3.5380896        
S   1
  1      2.5422363              1.0000000        
S   1
  1      1.5561536              1.0000000        
S   1
  1      0.9153844              1.0000000        
S   1
  1      0.4653603              1.0000000        
S   1
  1      0.2045671              1.0000000        
S   1
  1      0.1112405              1.0000000        
S   1
  1      0.0687820              1.0000000        
P   1
  1      5.9462204              1.0000000        
P   1
  1      2.0624858              1.0000000        
P   1
  1      0.7053392              1.0000000        
P   1
  1      0.2391997              1.0000000        
P   1
  1      0.0808938              1.0000000        
D   1
  1      2.7449282              1.0000000        
D   1
  1      1.1660024              1.0000000        
D   1
  1      0.4883430              1.0000000        
D   1
  1      0.2028178              1.0000000        
D   1
  1      0.0840000              1.0000000        
F   2
  1      1.3761326             -0.0164750        
  2      0.6115734              0.0087170        
F   1
  1      0.2755593              1.0000000        
G   1
  1      1.8119518              1.0000000        
G   1
  1      0.6678930              1.0000000        
G   1
  1      0.2446494              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Mo
data:
MOLYBDENUM
S   4
  1     22.6901662              0.1949917        
  2     13.6509970             -1.4097522        
  3      8.3560478              3.9693529        
  4      4.9153221             -3.9889833        
S   1
  1      3.0020634              1.0000000        
S   1
  1      1.7008034              1.0000000        
S   1
  1      1.0004726              1.0000000        
S   1
  1      0.5585539              1.0000000        
S   1
  1      0.2467601              1.0000000        
S   1
  1      0.1197869              1.0000000        
S   1
  1      0.0704629              1.0000000        
P   1
  1      1.7973997              1.0000000        
P   1
  1      0.8392010              1.0000000        
P   1
  1      0.3863176              1.0000000        
P   1
  1      0.1763512              1.0000000        
P   1
  1      0.0802794              1.0000000        
D   1
  1      2.5392437              1.0000000        
D   1
  1      1.1855659              1.0000000        
D   1
  1      0.5457631              1.0000000        
D   1
  1      0.2491370              1.0000000        
D   1
  1      0.1134133              1.0000000        
F   2
  1      1.7005722             -0.0210507        
  2      0.7055475              0.0101358        
F   1
  1      0.2986974              1.0000000        
G   1
  1      2.0378148              1.0000000        
G   1
  1      0.7511470              1.0000000        
G   1
  1      0.2751454              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Tc
data:
TECHNETIUM
S   4
  1     24.8047177              0.1969662        
  2     14.8842890             -1.3943496        
  3      8.7554639              4.4802534        
  4      5.2537931             -4.9671050        
S   1
  1      3.0753955              1.0000000        
S   1
  1      1.7821012              1.0000000        
S   1
  1      1.0482948              1.0000000        
S   1
  1      0.5837533              1.0000000        
S   1
  1      0.2253937              1.0000000        
S   1
  1      0.1255127              1.0000000        
S   1
  1      0.0738310              1.0000000        
P   1
  1      7.6664708              1.0000000        
P   1
  1      2.6591660              1.0000000        
P   1
  1      0.9093949              1.0000000        
P   1
  1      0.3084006              1.0000000        
P   1
  1      0.1042965              1.0000000        
D   1
  1      5.6542827              1.0000000        
D   1
  1      2.3987947              1.0000000        
D   1
  1      1.0009673              1.0000000        
D   1
  1      0.4136089              1.0000000        
D   1
  1      0.1703531              1.0000000        
F   2
  1      1.5866517             -0.0186055        
  2      0.6286164              0.0125267        
F   1
  1      0.2618564              1.0000000        
G   1
  1      2.2280694              1.0000000        
G   1
  1      0.8126598              1.0000000        
G   1
  1      0.2951546              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ru
data:
RUTHENIUM
S   4
  1     26.6762856              0.2165048        
  2     15.6919322             -1.6924857        
  3      9.5102427              5.1491315        
  4      5.5942603             -5.8321471        
S   1
  1      3.2101693              1.0000000        
S   1
  1      1.8788006              1.0000000        
S   1
  1      1.1051768              1.0000000        
S   1
  1      0.5884287              1.0000000        
S   1
  1      0.2485272              1.0000000        
S   1
  1      0.1323232              1.0000000        
S   1
  1      0.0778372              1.0000000        
P   1
  1      8.7134989              1.0000000        
P   1
  1      2.8784139              1.0000000        
P   1
  1      0.9374995              1.0000000        
P   1
  1      0.3027920              1.0000000        
P   1
  1      0.0975236              1.0000000        
D   1
  1      2.2115508              1.0000000        
D   1
  1      1.0869127              1.0000000        
D   1
  1      0.5266832              1.0000000        
D   1
  1      0.2530812              1.0000000        
D   1
  1      0.1212725              1.0000000        
F   2
  1      1.7397365             -0.0181947        
  2      0.7482841              0.0122301        
F   1
  1      0.3542304              1.0000000        
G   1
  1      2.5071456              1.0000000        
G   1
  1      0.9241443              1.0000000        
G   1
  1      0.3385144              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Rh
data:
RHODIUM
S   4
  1     29.3101190              0.2308387        
  2     17.2412460             -1.6855742        
  3     10.1419091              5.4619560        
  4      5.9658287             -6.5704893        
S   1
  1      3.3723789              1.0000000        
S   1
  1      1.9837523              1.0000000        
S   1
  1      1.1496062              1.0000000        
S   1
  1      0.6728683              1.0000000        
S   1
  1      0.3958049              1.0000000        
S   1
  1      0.2282225              1.0000000        
S   1
  1      0.0907871              1.0000000        
P   1
  1      4.4734721              1.0000000        
P   1
  1      2.1985809              1.0000000        
P   1
  1      1.0653622              1.0000000        
P   1
  1      0.5119266              1.0000000        
P   1
  1      0.2453071              1.0000000        
D   1
  1      6.5749622              1.0000000        
D   1
  1      2.8104159              1.0000000        
D   1
  1      1.2629928              1.0000000        
D   1
  1      0.5856334              1.0000000        
D   1
  1      0.2744598              1.0000000        
F   2
  1      1.7971363             -0.0240558        
  2      0.7726280              0.0164170        
F   1
  1      0.3300935              1.0000000        
G   1
  1      7.0667397              1.0000000        
G   1
  1      2.4807901              1.0000000        
G   1
  1      0.8654422              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Pd
data:
PALLADIUM
S   4
  1     51.0211803              0.0538811        
  2     17.6543867             -1.3608599        
  3     10.3849330              5.9322863        
  4      6.2315704             -7.8659686        
S   1
  1      3.6656295              1.0000000        
S   1
  1      2.1995933              1.0000000        
S   1
  1      1.2683839              1.0000000        
S   1
  1      0.7461081              1.0000000        
S   1
  1      0.4477087              1.0000000        
S   1
  1      0.2581689              1.0000000        
S   1
  1      0.1518640              1.0000000        
P   1
  1      5.6999676              1.0000000        
P   1
  1      2.5155374              1.0000000        
P   1
  1      1.1229524              1.0000000        
P   1
  1      0.5047808              1.0000000        
P   1
  1      0.2274325              1.0000000        
D   1
  1      3.8006002              1.0000000        
D   1
  1      1.5882692              1.0000000        
D   1
  1      0.6550157              1.0000000        
D   1
  1      0.2680210              1.0000000        
D   1
  1      0.1093843              1.0000000        
F   2
  1      2.0106185             -0.0150205        
  2      0.8268460              0.0105330        
F   1
  1      0.3451253              1.0000000        
G   1
  1      7.5375072              1.0000000        
G   1
  1      2.7664349              1.0000000        
G   1
  1      1.0133462              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ag
data:
SILVER
S   4
  1     33.0003921              0.2038586        
  2     19.4119948             -1.6877257        
  3     11.0829946              6.6111686        
  4      6.5194084             -9.3277547        
S   1
  1      3.7221609              1.0000000        
S   1
  1      2.2558505              1.0000000        
S   1
  1      1.3269709              1.0000000        
S   1
  1      0.7982463              1.0000000        
S   1
  1      0.3973142              1.0000000        
S   1
  1      0.1459674              1.0000000        
S   1
  1      0.0619668              1.0000000        
P   1
  1      8.6302966              1.0000000        
P   1
  1      2.6201449              1.0000000        
P   1
  1      0.8433914              1.0000000        
P   1
  1      0.2816572              1.0000000        
P   1
  1      0.0952523              1.0000000        
D   1
  1      7.2207512              1.0000000        
D   1
  1      3.2511233              1.0000000        
D   1
  1      1.4866000              1.0000000        
D   1
  1      0.6861688              1.0000000        
D   1
  1      0.3177130              1.0000000        
F   2
  1      4.3005188             -0.0015244        
  2      1.6452068             -0.0021536        
F   1
  1      0.6333305              1.0000000        
G   1
  1      4.3915496              1.0000000        
G   1
  1      2.0620255              1.0000000        
G   1
  1      0.9729182              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Cd
data:
CADMIUM
S   4
  1     51.9694461              0.0883266        
  2     20.2189912             -1.7697622        
  3     11.8935239              7.5473655        
  4      7.1368136            -10.1983309        
S   1
  1      4.0343163              1.0000000        
S   1
  1      2.4208270              1.0000000        
S   1
  1      1.4240158              1.0000000        
S   1
  1      0.7450006              1.0000000        
S   1
  1      0.2949185              1.0000000        
S   1
  1      0.1704979              1.0000000        
S   1
  1      0.1002929              1.0000000        
P   1
  1      1.8931176              1.0000000        
P   1
  1      0.8838914              1.0000000        
P   1
  1      0.4068903              1.0000000        
P   1
  1      0.1857425              1.0000000        
P   1
  1      0.0845546              1.0000000        
D   1
  1      8.6400749              1.0000000        
D   1
  1      3.0268264              1.0000000        
D   1
  1      1.0897690              1.0000000        
D   1
  1      0.3989943              1.0000000        
D   1
  1      0.1469111              1.0000000        
F   2
  1      3.2884486              0.0037392        
  2      1.3487599             -0.0029125        
F   1
  1      0.5670248              1.0000000        
G   1
  1      5.9447998              1.0000000        
G   1
  1      2.0610067              1.0000000        
G   1
  1      0.7189977              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: In
data:
INDIUM
S   4
  1     49.9211080              0.1736250        
  2     29.3653568             -0.8112730        
  3     11.7138181              6.3143059        
  4      6.8904810            -12.3674999        
S   1
  1      4.0937562              1.0000000        
S   1
  1      2.4080918              1.0000000        
S   1
  1      1.4815213              1.0000000        
S   1
  1      0.7966937              1.0000000        
S   1
  1      0.2883217              1.0000000        
S   1
  1      0.1696010              1.0000000        
S   1
  1      0.0856835              1.0000000        
P   2
  1      3.7832538              1.0000000        
  2      1.3534047              1.0000000        
P   1
  1      0.5058912              1.0000000        
P   1
  1      0.1943310              1.0000000        
P   1
  1      0.0753446              1.0000000        
D   3
  1      9.5381158             -0.0036902        
  2      3.3034566              0.0200371        
  3      1.1799064             -0.0213596        
D   1
  1      0.4294894              1.0000000        
D   1
  1      0.1573383              1.0000000        
F   2
  1      1.1653200             -0.0017274        
  2      0.3487082              0.0022936        
F   1
  1      0.1039500              1.0000000        
G   1
  1      0.6332593              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Sn
data:
TIN
S   4
  1     31.2387916             -0.4647563        
  2     19.1218880              0.7746856        
  3     11.2481691              4.9426802        
  4      6.8852289            -13.7382140        
S   1
  1      4.1524054              1.0000000        
S   1
  1      2.2894704              1.0000000        
S   1
  1      1.3467473              1.0000000        
S   1
  1      0.5371532              1.0000000        
S   1
  1      0.2741191              1.0000000        
S   1
  1      0.1612465              1.0000000        
S   1
  1      0.0782836              1.0000000        
P   2
  1      4.2249132              1.0000000        
  2      1.5867453              1.0000000        
P   1
  1      0.5870916              1.0000000        
P   1
  1      0.2153060              1.0000000        
P   1
  1      0.0787283              1.0000000        
D   3
  1      3.1923180             -0.0186449        
  2      1.3067780              0.0245523        
  3      0.5384098             -0.0179147        
D   1
  1      0.2227010              1.0000000        
D   1
  1      0.0922357              1.0000000        
F   2
  1      1.4966252             -0.0014873        
  2      0.6167066              0.0017655        
F   1
  1      0.2536500              1.0000000        
G   1
  1      0.5747157              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Sb
data:
ANTIMONY
S   4
  1     57.7143676              0.2216592        
  2     33.9496271             -0.9373366        
  3     13.1424655              7.5699431        
  4      7.7308618            -15.5941282        
S   1
  1      4.6853613              1.0000000        
S   1
  1      2.7560948              1.0000000        
S   1
  1      1.6703571              1.0000000        
S   1
  1      0.8567648              1.0000000        
S   1
  1      0.3459747              1.0000000        
S   1
  1      0.1941107              1.0000000        
S   1
  1      0.1141828              1.0000000        
P   2
  1      4.8928790              0.0161202        
  2      1.7252227             -0.0430711        
P   1
  1      0.6206252              1.0000000        
P   1
  1      0.2260065              1.0000000        
P   1
  1      0.0826410              1.0000000        
D   3
  1      3.1261744              0.0079150        
  2      1.3258246             -0.0129211        
  3      0.5750726              0.0118939        
D   1
  1      0.2528859              1.0000000        
D   1
  1      0.1117206              1.0000000        
F   2
  1      1.8404045              0.0032631        
  2      0.9629380             -0.0072133        
F   1
  1      0.5029600              1.0000000        
G   1
  1      0.7040401              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Te
data:
TELLURIUM
S   4
  1     45.8923171              0.2824062        
  2     25.9421266             -2.6481348        
  3     15.2600740             10.3488865        
  4      8.9765139            -15.0383635        
S   1
  1      5.2803021              1.0000000        
S   1
  1      3.1684917              1.0000000        
S   1
  1      1.8638186              1.0000000        
S   1
  1      1.1184008              1.0000000        
S   1
  1      0.3869899              1.0000000        
S   1
  1      0.2276411              1.0000000        
S   1
  1      0.1339065              1.0000000        
P   2
  1      5.5689637              0.0192092        
  2      2.0332966             -0.0471192        
P   1
  1      0.7319547              1.0000000        
P   1
  1      0.2612903              1.0000000        
P   1
  1      0.0930153              1.0000000        
D   3
  1      4.1438402              0.0169742        
  2      1.6316912             -0.0193454        
  3      0.6537365              0.0174281        
D   1
  1      0.2646969              1.0000000        
D   1
  1      0.1075556              1.0000000        
F   2
  1      1.7885159             -0.0030102        
  2      0.7768242              0.0046119        
F   1
  1      0.3367900              1.0000000        
G   1
  1      0.7345132              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: I
data:
IODINE
S   4
  1    129.9537471              0.0331547        
  2     25.6994960             -2.2540948        
  3     15.6359930             10.9929981        
  4      9.2032587            -17.9755829        
S   1
  1      5.4136814              1.0000000        
S   1
  1      3.1529885              1.0000000        
S   1
  1      1.8546991              1.0000000        
S   1
  1      0.6481820              1.0000000        
S   1
  1      0.3812835              1.0000000        
S   1
  1      0.2220638              1.0000000        
S   1
  1      0.1306257              1.0000000        
P   2
  1      6.3414007              0.0175949        
  2      2.2502515             -0.0450366        
P   1
  1      0.7853950              1.0000000        
P   1
  1      0.2714491              1.0000000        
P   1
  1      0.0935145              1.0000000        
D   3
  1     14.1399698              0.0037566        
  2      5.2162306             -0.0186363        
  3      1.9554103              0.0143662        
D   1
  1      0.7402137              1.0000000        
D   1
  1      0.2811242              1.0000000        
F   2
  1      1.8878261             -0.0038611        
  2      0.7736294              0.0075270        
F   1
  1      0.3166600              1.0000000        
G   1
  1      0.9097867              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Xe
data:
XENON
S   4
  1     50.8073424              0.5191416        
  2     29.8866712             -3.6511464        
  3     17.5803943             12.5652412        
  4     10.3414081            -17.1144379        
S   1
  1      6.0831811              1.0000000        
S   1
  1      3.5783417              1.0000000        
S   1
  1      2.1049068              1.0000000        
S   1
  1      0.7283414              1.0000000        
S   1
  1      0.4284361              1.0000000        
S   1
  1      0.2520212              1.0000000        
S   1
  1      0.1482478              1.0000000        
P   2
  1      7.1700000              0.0175949        
  2      2.5400000             -0.0450366        
P   1
  1      0.8900000              1.0000000        
P   1
  1      0.3100000              1.0000000        
P   1
  1      0.1100000              1.0000000        
D   3
  1     15.9800000              0.0037566        
  2      5.8900000             -0.0186363        
  3      2.2100000              0.0143662        
D   1
  1      0.8400000              1.0000000        
D   1
  1      0.3200000              1.0000000        
F   2
  1      2.1300000             -0.0038611        
  2      0.8700000              0.0075270        
F   1
  1      0.3600000              1.0000000        
G   1
  1      1.0300000              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Cs
data:
CESIUM
S   4
  1     16.5325652             -0.0169720        
  2      9.7250381              0.1460652        
  3      5.7344868             -0.6702244        
  4      3.3315825              1.7636965        
S   1
  1      1.9992444              1.0000000        
S   1
  1      1.1528537              1.0000000        
S   1
  1      0.6849307              1.0000000        
S   1
  1      0.4029004              1.0000000        
S   1
  1      0.2297292              1.0000000        
S   1
  1      0.0489643              1.0000000        
S   1
  1      0.0274712              1.0000000        
P   2
  1      2.5056618              0.0117986        
  2      0.8678690             -0.0355306        
P   1
  1      0.2966131              1.0000000        
P   1
  1      0.1005740              1.0000000        
P   1
  1      0.0340126              1.0000000        
D   2
  1      1.1521088              0.0016446        
  2      0.4611706             -0.0096583        
D   1
  1      0.1881060              1.0000000        
D   1
  1      0.0776108              1.0000000        
D   1
  1      0.0321450              1.0000000        
F   3
  1      0.6157554             -0.0045421        
  2      0.2296413              0.0003306        
  3      0.0867322              0.0007464        
G   1
  1      0.2855416              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ba
data:
BARIUM
S   4
  1     17.6467454             -0.2043885        
  2     10.8570096              0.9988078        
  3      6.5148441             -2.6422189        
  4      3.8322611              4.5348196        
S   1
  1      2.2995820              1.0000000        
S   1
  1      1.2999136              1.0000000        
S   1
  1      0.7800246              1.0000000        
S   1
  1      0.4588380              1.0000000        
S   1
  1      0.0933926              1.0000000        
S   1
  1      0.0549368              1.0000000        
S   1
  1      0.0194505              1.0000000        
P   2
  1      3.3090543              0.0084477        
  2      1.2476719             -0.0279101        
P   1
  1      0.4630816              1.0000000        
P   1
  1      0.1702794              1.0000000        
P   1
  1      0.0624200              1.0000000        
D   2
  1      1.3764634              0.0029492        
  2      0.6669676             -0.0080408        
D   1
  1      0.3208320              1.0000000        
D   1
  1      0.1536602              1.0000000        
D   1
  1      0.0734882              1.0000000        
F   3
  1      2.0118372              0.0046272        
  2      0.9229160             -0.0111932        
  3      0.4226647              0.0000323        
G   1
  1      0.5296055              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: La
data:
LANTHANUM
S   4
  1     17.6099386             -0.0360198        
  2     10.3587871              0.2868368        
  3      6.0934040             -1.2729320        
  4      3.5843552              3.3276739        
S   1
  1      2.1084442              1.0000000        
S   1
  1      0.7368611              1.0000000        
S   1
  1      0.4334477              1.0000000        
S   1
  1      0.2524448              1.0000000        
S   1
  1      0.1484969              1.0000000        
S   1
  1      0.0873511              1.0000000        
S   1
  1      0.0513830              1.0000000        
P   1
  1      4.2941634              1.0000000        
P   1
  1      1.5678515              1.0000000        
P   1
  1      0.5644018              1.0000000        
P   1
  1      0.2014779              1.0000000        
P   1
  1      0.0717230              1.0000000        
D   1
  1      1.3700039              1.0000000        
D   1
  1      0.7087546              1.0000000        
D   1
  1      0.3615157              1.0000000        
D   1
  1      0.1828580              1.0000000        
D   1
  1      0.0922343              1.0000000        
F   2
  1      0.9957125             -0.0092472        
  2      0.4731394             -0.0027479        
F   1
  1      0.2234196              1.0000000        
G   1
  1      1.6277423              1.0000000        
G   1
  1      0.5999926              1.0000000        
G   1
  1      0.2197775              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Hf
data:
HAFNIUM
S   4
  1     22.7379198              0.3386767        
  2     13.9893113             -1.8152067        
  3      8.3944093              4.0726485        
  4      4.9378877             -3.1262643        
S   1
  1      2.8474069              1.0000000        
S   1
  1      1.7086116              1.0000000        
S   1
  1      1.0050656              1.0000000        
S   1
  1      0.5090252              1.0000000        
S   1
  1      0.2005007              1.0000000        
S   1
  1      0.1203369              1.0000000        
S   1
  1      0.0707864              1.0000000        
P   1
  1      8.6876159              1.0000000        
P   1
  1      2.9520544              1.0000000        
P   1
  1      0.9882283              1.0000000        
P   1
  1      0.3279003              1.0000000        
P   1
  1      0.1084804              1.0000000        
D   1
  1      5.3853247              1.0000000        
D   1
  1      1.8910042              1.0000000        
D   1
  1      0.7054322              1.0000000        
D   1
  1      0.2733923              1.0000000        
D   1
  1      0.1073454              1.0000000        
F   2
  1      1.5856277             -0.0163882        
  2      0.5025690              0.0070772        
F   1
  1      0.1806953              1.0000000        
G   1
  1      1.5143193              1.0000000        
G   1
  1      0.6169406              1.0000000        
G   1
  1      0.2497735              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ta
data:
TANTALUM
S   4
  1     22.8527132              0.3259813        
  2     13.7139915             -2.0490751        
  3      8.4118450              4.8778884        
  4      5.2011925             -3.6263453        
S   1
  1      2.9545148              1.0000000        
S   1
  1      1.8085175              1.0000000        
S   1
  1      1.0638338              1.0000000        
S   1
  1      0.5459089              1.0000000        
S   1
  1      0.2367153              1.0000000        
S   1
  1      0.1273732              1.0000000        
S   1
  1      0.0749254              1.0000000        
P   1
  1      4.9406412              1.0000000        
P   1
  1      1.8988299              1.0000000        
P   1
  1      0.7195251              1.0000000        
P   1
  1      0.2703718              1.0000000        
P   1
  1      0.1013138              1.0000000        
D   1
  1      2.7629851              1.0000000        
D   1
  1      1.1049374              1.0000000        
D   1
  1      0.4659311              1.0000000        
D   1
  1      0.2031096              1.0000000        
D   1
  1      0.0895480              1.0000000        
F   2
  1      1.1163028             -0.0135587        
  2      0.4585788              0.0111379        
F   1
  1      0.1960556              1.0000000        
G   1
  1      1.4844387              1.0000000        
G   1
  1      0.5603502              1.0000000        
G   1
  1      0.2110499              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: W
data:
TUNGSTEN
S   4
  1     23.3623178              0.4033255        
  2     14.3384253             -2.2969338        
  3      8.6473457              5.4965831        
  4      5.2932130             -4.3250365        
S   1
  1      3.1136546              1.0000000        
S   1
  1      1.7817313              1.0000000        
S   1
  1      1.0773891              1.0000000        
S   1
  1      0.6337583              1.0000000        
S   1
  1      0.3727990              1.0000000        
S   1
  1      0.2192935              1.0000000        
S   1
  1      0.1080597              1.0000000        
P   1
  1      1.7902753              1.0000000        
P   1
  1      0.8321368              1.0000000        
P   1
  1      0.3852473              1.0000000        
P   1
  1      0.1779303              1.0000000        
P   1
  1      0.0821137              1.0000000        
D   1
  1      2.4029601              1.0000000        
D   1
  1      1.1219355              1.0000000        
D   1
  1      0.5164715              1.0000000        
D   1
  1      0.2357655              1.0000000        
D   1
  1      0.1073263              1.0000000        
F   2
  1      1.4801525             -0.0249226        
  2      0.6352033              0.0149743        
F   1
  1      0.2766107              1.0000000        
G   1
  1      1.6963435              1.0000000        
G   1
  1      0.6692890              1.0000000        
G   1
  1      0.2671445              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Re
data:
RHENIUM
S   4
  1     25.3049480              0.4805131        
  2     15.2611343             -2.6865851        
  3      9.3416450              5.8254490        
  4      5.4950851             -4.3673994        
S   1
  1      3.1062758              1.0000000        
S   1
  1      1.9014134              1.0000000        
S   1
  1      1.1184785              1.0000000        
S   1
  1      0.5851929              1.0000000        
S   1
  1      0.2559532              1.0000000        
S   1
  1      0.1339158              1.0000000        
S   1
  1      0.0787740              1.0000000        
P   1
  1      2.2033341              1.0000000        
P   1
  1      1.0225949              1.0000000        
P   1
  1      0.4813040              1.0000000        
P   1
  1      0.2284716              1.0000000        
P   1
  1      0.1087638              1.0000000        
D   1
  1      6.4096346              1.0000000        
D   1
  1      2.3402359              1.0000000        
D   1
  1      0.8424480              1.0000000        
D   1
  1      0.3007337              1.0000000        
D   1
  1      0.1070565              1.0000000        
F   2
  1      5.9179950              0.0027189        
  2      1.9083953             -0.0176365        
F   1
  1      0.6243117              1.0000000        
G   1
  1      1.8573388              1.0000000        
G   1
  1      0.8348138              1.0000000        
G   1
  1      0.3813500              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Os
data:
OSMIUM
S   4
  1     26.0004809              0.4711836        
  2     15.9154135             -2.4793345        
  3      9.3620077              5.8099433        
  4      5.3039968             -5.3265065        
S   1
  1      3.1130468              1.0000000        
S   1
  1      1.9055581              1.0000000        
S   1
  1      1.1209165              1.0000000        
S   1
  1      0.5864575              1.0000000        
S   1
  1      0.2565159              1.0000000        
S   1
  1      0.1342077              1.0000000        
S   1
  1      0.0789457              1.0000000        
P   1
  1      9.5838254              1.0000000        
P   1
  1      3.1659172              1.0000000        
P   1
  1      1.0311393              1.0000000        
P   1
  1      0.3330356              1.0000000        
P   1
  1      0.1072645              1.0000000        
D   1
  1      8.0476299              1.0000000        
D   1
  1      2.3090979              1.0000000        
D   1
  1      0.7062430              1.0000000        
D   1
  1      0.2249058              1.0000000        
D   1
  1      0.0726195              1.0000000        
F   2
  1      1.6056776             -0.0197608        
  2      0.5636757              0.0153960        
F   1
  1      0.1966425              1.0000000        
G   1
  1      1.9148331              1.0000000        
G   1
  1      0.7411062              1.0000000        
G   1
  1      0.2850409              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Ir
data:
IRIDIUM
S   4
  1     26.6307757              0.5177215        
  2     16.0607263             -2.9928774        
  3      9.8310912              6.7312034        
  4      5.7829947             -5.3059791        
S   1
  1      3.2690260              1.0000000        
S   1
  1      2.0010361              1.0000000        
S   1
  1      1.1770800              1.0000000        
S   1
  1      0.6490030              1.0000000        
S   1
  1      0.2810451              1.0000000        
S   1
  1      0.1409322              1.0000000        
S   1
  1      0.0829013              1.0000000        
P   1
  1      8.1966999              1.0000000        
P   1
  1      3.0002158              1.0000000        
P   1
  1      1.0827372              1.0000000        
P   1
  1      0.3874799              1.0000000        
P   1
  1      0.1382825              1.0000000        
D   1
  1      3.9845055              1.0000000        
D   1
  1      1.4679208              1.0000000        
D   1
  1      0.5748278              1.0000000        
D   1
  1      0.2339323              1.0000000        
D   1
  1      0.0964630              1.0000000        
F   2
  1      1.5804788             -0.0166654        
  2      0.5284091              0.0154318        
F   1
  1      0.1755614              1.0000000        
G   1
  1      2.0107759              1.0000000        
G   1
  1      0.7782394              1.0000000        
G   1
  1      0.2993228              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Pt
data:
PLATINUM
S   4
  1     27.3032355              0.4254407        
  2     16.0607263             -2.8743600        
  3      9.7344766              7.4335236        
  4      5.7829947             -6.8140678        
S   1
  1      3.4017615              1.0000000        
S   1
  1      2.0208964              1.0000000        
S   1
  1      1.1311508              1.0000000        
S   1
  1      0.6653828              1.0000000        
S   1
  1      0.3914016              1.0000000        
S   1
  1      0.2302363              1.0000000        
S   1
  1      0.1126025              1.0000000        
P   1
  1      6.1685356              1.0000000        
P   1
  1      2.7429261              1.0000000        
P   1
  1      1.2025503              1.0000000        
P   1
  1      0.5228149              1.0000000        
P   1
  1      0.2266651              1.0000000        
D   1
  1      3.0954010              1.0000000        
D   1
  1      1.3785036              1.0000000        
D   1
  1      0.6220505              1.0000000        
D   1
  1      0.2829541              1.0000000        
D   1
  1      0.1290536              1.0000000        
F   2
  1      1.6832598             -0.0198753        
  2      0.7163718              0.0180265        
F   1
  1      0.3083391              1.0000000        
G   1
  1      2.1558237              1.0000000        
G   1
  1      0.8343779              1.0000000        
G   1
  1      0.3209146              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Au
data:
GOLD
S   4
  1     28.2452505              0.4467851        
  2     16.5778354             -3.0662858        
  3     10.1476241              7.7959203        
  4      5.9691905             -7.0482833        
S   1
  1      3.6538607              1.0000000        
S   1
  1      2.1445411              1.0000000        
S   1
  1      1.2614947              1.0000000        
S   1
  1      0.7146933              1.0000000        
S   1
  1      0.4204078              1.0000000        
S   1
  1      0.2199551              1.0000000        
S   1
  1      0.0962081              1.0000000        
P   1
  1      7.5722886              1.0000000        
P   1
  1      2.6998544              1.0000000        
P   1
  1      0.9635729              1.0000000        
P   1
  1      0.3441024              1.0000000        
P   1
  1      0.1229071              1.0000000        
D   1
  1      6.8027810              1.0000000        
D   1
  1      2.9625600              1.0000000        
D   1
  1      1.3082794              1.0000000        
D   1
  1      0.5826481              1.0000000        
D   1
  1      0.2602216              1.0000000        
F   2
  1      1.9754530             -0.0124600        
  2      0.8157566              0.0106630        
F   1
  1      0.3408128              1.0000000        
G   1
  1      2.3463119              1.0000000        
G   1
  1      0.8956940              1.0000000        
G   1
  1      0.3442127              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Hg
data:
MERCURY
S   4
  1     27.8729499              0.3331174        
  2     16.3958524             -2.5730499        
  3      9.6446188              8.4196819        
  4      5.6733050            -10.6735979        
S   1
  1      1.9630812              1.0000000        
S   1
  1      1.1547536              1.0000000        
S   1
  1      0.6792668              1.0000000        
S   1
  1      0.3995687              1.0000000        
S   1
  1      0.2350404              1.0000000        
S   1
  1      0.1382591              1.0000000        
S   1
  1      0.0813289              1.0000000        
P   1
  1      1.6943070              1.0000000        
P   1
  1      0.8362763              1.0000000        
P   1
  1      0.4059931              1.0000000        
P   1
  1      0.1951779              1.0000000        
P   1
  1      0.0935262              1.0000000        
D   1
  1      8.3848824              1.0000000        
D   1
  1      2.9083518              1.0000000        
D   1
  1      0.9946128              1.0000000        
D   1
  1      0.3373002              1.0000000        
D   1
  1      0.1140699              1.0000000        
F   2
  1      3.7826413              0.0014967        
  2      0.8757371             -0.0000768        
F   1
  1      0.2037884              1.0000000        
G   1
  1      5.1623898              1.0000000        
G   1
  1      1.9992876              1.0000000        
G   1
  1      0.7792167              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Tl
data:
THALLIUM
S   4
  1     28.5237942              0.5451875        
  2     16.9909666             -3.7517060        
  3     10.2982993             10.5302531        
  4      6.1795851            -11.2564261        
S   1
  1      3.6350500              1.0000000        
S   1
  1      2.1812437              1.0000000        
S   1
  1      1.2578027              1.0000000        
S   1
  1      0.7398839              1.0000000        
S   1
  1      0.4541143              1.0000000        
S   1
  1      0.2357894              1.0000000        
S   1
  1      0.0866223              1.0000000        
P   2
  1      3.1078607              1.0000000        
  2      1.2541619              1.0000000        
P   1
  1      0.4990026              1.0000000        
P   1
  1      0.1968827              1.0000000        
P   1
  1      0.0774648              1.0000000        
D   3
  1      2.6804781              0.0216744        
  2      1.0546514             -0.0246906        
  3      0.4149594              0.0145071        
D   1
  1      6.8126425              1.0000000        
D   1
  1      0.1632685              1.0000000        
F   2
  1      1.0581890             -0.0008685        
  2      0.4302107             -0.0012987        
F   1
  1      0.1747600              1.0000000        
G   1
  1      0.5623024              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Pb
data:
LEAD
S   4
  1     29.5485529              0.7353872        
  2     18.1581268             -4.3747100        
  3     10.9509655             11.7080215        
  4      6.7033046            -11.4066284        
S   1
  1      3.9431203              1.0000000        
S   1
  1      2.4167925              1.0000000        
S   1
  1      1.3325968              1.0000000        
S   1
  1      0.7327981              1.0000000        
S   1
  1      0.3018818              1.0000000        
S   1
  1      0.1633603              1.0000000        
S   1
  1      0.0960943              1.0000000        
P   2
  1      9.9012410              1.0000000        
  2      3.9873925              1.0000000        
P   1
  1      1.5850638              1.0000000        
P   1
  1      0.6252510              1.0000000        
P   1
  1      0.2460090              1.0000000        
D   3
  1      2.5385939             -0.0187104        
  2      1.1178518              0.0268522        
  3      0.5013434             -0.0164630        
D   1
  1      0.2273702              1.0000000        
D   1
  1      0.1035045              1.0000000        
F   2
  1      1.2755120              0.0006869        
  2      0.5727848             -0.0030805        
F   1
  1      0.2584277              1.0000000        
G   1
  1      0.5880719              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Bi
data:
BISMUTH
S   4
  1     51.8020205             -0.2855255        
  2     32.1121772              1.5761605        
  3     19.0788827             -5.7114949        
  4     11.3351005             13.6149056        
S   1
  1      6.6677060              1.0000000        
S   1
  1      2.1778861              1.0000000        
S   1
  1      1.1696389              1.0000000        
S   1
  1      0.5448910              1.0000000        
S   1
  1      0.2762376              1.0000000        
S   1
  1      0.1624927              1.0000000        
S   1
  1      0.0881553              1.0000000        
P   2
  1      3.8557206              0.0289384        
  2      1.5122274             -0.0641238        
P   1
  1      0.5833643              1.0000000        
P   1
  1      0.2228465              1.0000000        
P   1
  1      0.0848520              1.0000000        
D   3
  1      2.4355837              0.0063489        
  2      1.1371674             -0.0112341        
  3      0.5234833              0.0096554        
D   1
  1      0.2389664              1.0000000        
D   1
  1      0.1087834              1.0000000        
F   2
  1      1.4889569              0.0010265        
  2      0.7030956             -0.0030812        
F   1
  1      0.3321300              1.0000000        
G   1
  1      0.6087002              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Po
data:
POLONIUM
S   4
  1     31.3175589              0.7608235        
  2     19.1251422             -4.9725625        
  3     11.5341618             14.6710182        
  4      7.0602907            -16.7007606        
S   1
  1      4.1531121              1.0000000        
S   1
  1      2.4430070              1.0000000        
S   1
  1      1.4370629              1.0000000        
S   1
  1      0.7805294              1.0000000        
S   1
  1      0.3329869              1.0000000        
S   1
  1      0.1720601              1.0000000        
S   1
  1      0.1012118              1.0000000        
P   2
  1      5.0763703              0.0240603        
  2      1.8637706             -0.0504364        
P   1
  1      0.6746659              1.0000000        
P   1
  1      0.2421813              1.0000000        
P   1
  1      0.0866931              1.0000000        
D   3
  1      3.1636527              0.0144840        
  2      1.3438700             -0.0171571        
  3      0.5628372              0.0149380        
D   1
  1      0.2337566              1.0000000        
D   1
  1      0.0968137              1.0000000        
F   2
  1      1.5891020              0.0023563        
  2      0.8314513             -0.0059191        
F   1
  1      0.4345900              1.0000000        
G   1
  1      0.6841917              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: At
data:
ASTATINE
S   4
  1     58.2038317             -0.1848414        
  2     34.0669993              1.3286913        
  3     20.0394108             -6.1129447        
  4     12.1767940             15.6815457        
S   1
  1      7.1628198              1.0000000        
S   1
  1      2.5537111              1.0000000        
S   1
  1      1.5021830              1.0000000        
S   1
  1      0.5816041              1.0000000        
S   1
  1      0.3057567              1.0000000        
S   1
  1      0.1798569              1.0000000        
S   1
  1      0.0998997              1.0000000        
P   2
  1      4.9506786              0.0303578        
  2      1.8979309             -0.0665855        
P   1
  1      0.7173865              1.0000000        
P   1
  1      0.2688942              1.0000000        
P   1
  1      0.1005083              1.0000000        
D   3
  1     10.1118169              0.0067863        
  2      4.0805739             -0.0229907        
  3      1.6235678              0.0185183        
D   1
  1      0.6405826              1.0000000        
D   1
  1      0.2520414              1.0000000        
F   2
  1      1.5362787             -0.0014670        
  2      0.7613943              0.0002276        
F   1
  1      0.3770300              1.0000000        
G   1
  1      0.8223522              1.0000000        


name: Weigend Coulomb Fitting
description: Improved Auxiliary Basis Sets
elt: Rn
data:
RADON
S   4
  1     97.3217241             -0.0611041        
  2     57.2480714              0.2276353        
  3     19.8090201             -3.3477431        
  4     11.6523645             14.3525060        
S   1
  1      6.8543318              1.0000000        
S   1
  1      4.0319598              1.0000000        
S   1
  1      2.3717410              1.0000000        
S   1
  1      1.3951417              1.0000000        
S   1
  1      0.4827480              1.0000000        
S   1
  1      0.2839694              1.0000000        
S   1
  1      0.1670408              1.0000000        
P   2
  1      4.9506786              0.0303578        
  2      1.8979309             -0.0665855        
P   1
  1      0.7173865              1.0000000        
P   1
  1      0.2688942              1.0000000        
P   1
  1      0.1005083              1.0000000        
D   3
  1     10.1118169              0.0067863        
  2      4.0805739             -0.0229907        
  3      1.6235678              0.0185183        
D   1
  1      0.6405826              1.0000000        
D   1
  1      0.2520414              1.0000000        
F   2
  1      1.5362787             -0.0014670        
  2      0.7613943              0.0002276        
F   1
  1      0.3770300              1.0000000        
G   1
  1      0.8223522              1.0000000        


name: Zn-ECP10MDF-ECP10MDF
description: [37] D. Figgen, G. Rauhut, M. Dolg, H. Stoll, Chem. Phys. 311, 227 (2005).
elt: Zn
data:
ZINC
S   11
  1   2023.6204380              0.0001650        
  2    282.2060630              0.0009450        
  3     64.6048770             -0.0199110        
  4     44.2444800              0.0666130        
  5     11.6528930             -0.4188200        
  6      2.7262380              0.6226820        
  7      1.3066500              0.5079450        
  8      0.8984630              0.0028810        
  9      0.6161720              0.0969400        
 10      0.1829760              0.0008460        
 11      0.0790600              0.0003740        
S   11
  1   2023.6204380             -0.0000440        
  2    282.2060630             -0.0001910        
  3     64.6048770              0.0038250        
  4     44.2444800             -0.0145870        
  5     11.6528930              0.1062640        
  6      2.7262380             -0.2023000        
  7      1.3066500             -0.1513700        
  8      0.8984630             -0.1615570        
  9      0.6161720              0.0298540        
 10      0.1829760              0.4457090        
 11      0.0790600              0.5411470        
S   11
  1   2023.6204380             -0.0001460        
  2    282.2060630             -0.0001850        
  3     64.6048770              0.0029470        
  4     44.2444800             -0.0278530        
  5     11.6528930              0.2982140        
  6      2.7262380             -1.0050770        
  7      1.3066500              0.5577680        
  8      0.8984630             -1.6681820        
  9      0.6161720              1.9904160        
 10      0.1829760              0.7666310        
 11      0.0790600             -0.7381870        
S   11
  1   2023.6204380             -0.0002810        
  2    282.2060630              0.0008300        
  3     64.6048770             -0.0183840        
  4     44.2444800             -0.0031140        
  5     11.6528930              0.4047250        
  6      2.7262380             -2.0405280        
  7      1.3066500              1.7437330        
  8      0.8984630             -1.1256920        
  9      0.6161720              2.0944600        
 10      0.1829760             -1.9150060        
 11      0.0790600              0.0325000        
S   11
  1   2023.6204380             -0.0007250        
  2    282.2060630              0.0061370        
  3     64.6048770             -0.1252860        
  4     44.2444800              0.1563740        
  5     11.6528930              0.3926390        
  6      2.7262380             -3.8453900        
  7      1.3066500              6.9960940        
  8      0.8984630             -1.3739490        
  9      0.6161720             -2.8459700        
 10      0.1829760             -0.6204270        
 11      0.0790600              2.6505690        
S   1
  1      0.0348020              1.0000000        
P   11
  1    403.8185880              0.0002040        
  2     64.1764750              0.0053560        
  3     30.2572870             -0.0185660        
  4     17.0853930             -0.0718200        
  5      5.0720530              0.2980750        
  6      2.4603900              0.4719150        
  7      1.1433550              0.3131210        
  8      0.4782630              0.0580560        
  9      0.1981500             -0.0015320        
 10      0.0786070              0.0016270        
 11      0.0290200             -0.0005600        
P   11
  1    403.8185880             -0.0000340        
  2     64.1764750             -0.0009970        
  3     30.2572870              0.0037420        
  4     17.0853930              0.0117840        
  5      5.0720530             -0.0587400        
  6      2.4603900             -0.0896120        
  7      1.1433550             -0.0700230        
  8      0.4782630              0.0522240        
  9      0.1981500              0.3042230        
 10      0.0786070              0.5397720        
 11      0.0290200              0.2642630        
P   11
  1    403.8185880             -0.0001250        
  2     64.1764750             -0.0045880        
  3     30.2572870              0.0200280        
  4     17.0853930              0.0423080        
  5      5.0720530             -0.3156010        
  6      2.4603900             -0.3565860        
  7      1.1433550              0.1385400        
  8      0.4782630              0.7128770        
  9      0.1981500              0.3847660        
 10      0.0786070             -0.4588150        
 11      0.0290200             -0.3188270        
P   11
  1    403.8185880             -0.0001640        
  2     64.1764750             -0.0086310        
  3     30.2572870              0.0439220        
  4     17.0853930              0.0529070        
  5      5.0720530             -0.7236270        
  6      2.4603900             -0.2618350        
  7      1.1433550              1.1113050        
  8      0.4782630              0.2324610        
  9      0.1981500             -1.2102160        
 10      0.0786070              0.3295390        
 11      0.0290200              0.4574270        
P   11
  1    403.8185880              0.0000580        
  2     64.1764750              0.0157640        
  3     30.2572870             -0.0952900        
  4     17.0853930             -0.0070200        
  5      5.0720530              1.4221640        
  6      2.4603900             -1.2366070        
  7      1.1433550             -0.9085590        
  8      0.4782630              2.1465410        
  9      0.1981500             -1.3265680        
 10      0.0786070             -0.2134710        
 11      0.0290200              0.6539860        
P   1
  1      0.0096750              1.0000000        
D   9
  1    164.7786390              0.0024400        
  2     51.4643980              0.0236740        
  3     20.4314220              0.0893040        
  4      8.7116430              0.2158950        
  5      3.8087110              0.3308520        
  6      1.6249680              0.3468200        
  7      0.6559570              0.2614530        
  8      0.2380030              0.1006390        
  9      0.0900000              0.0043640        
D   9
  1    164.7786390             -0.0033720        
  2     51.4643980             -0.0327560        
  3     20.4314220             -0.1275360        
  4      8.7116430             -0.3182860        
  5      3.8087110             -0.3609140        
  6      1.6249680              0.1004380        
  7      0.6559570              0.5393740        
  8      0.2380030              0.3095200        
  9      0.0900000              0.0283130        
D   9
  1    164.7786390              0.0035040        
  2     51.4643980              0.0350290        
  3     20.4314220              0.1394210        
  4      8.7116430              0.3770570        
  5      3.8087110              0.0850280        
  6      1.6249680             -0.6995140        
  7      0.6559570             -0.0932820        
  8      0.2380030              0.6399350        
  9      0.0900000              0.2549140        
D   9
  1    164.7786390             -0.0046990        
  2     51.4643980             -0.0475100        
  3     20.4314220             -0.1996760        
  4      8.7116430             -0.5424450        
  5      3.8087110              0.5263360        
  6      1.6249680              0.6134260        
  7      0.6559570             -1.0241460        
  8      0.2380030              0.2152220        
  9      0.0900000              0.5933480        
F   1
  1      6.4600000              1.0000000        
F   1
  1      1.7430000              1.0000000        
F   1
  1      0.4700000              1.0000000        
G   1
  1      5.0780000              1.0000000        
G   1
  1      1.3700000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: H
data:
HYDROGEN
S   3
  1     82.6400000              0.0020060        
  2     12.4100000              0.0153430        
  3      2.8240000              0.0755790        
S   1
  1      0.7977000              1.0000000        
S   1
  1      0.2581000              1.0000000        
S   1
  1      0.0898900              1.0000000        
P   1
  1      2.2920000              1.0000000        
P   1
  1      0.8380000              1.0000000        
P   1
  1      0.2920000              1.0000000        
D   1
  1      2.0620000              1.0000000        
D   1
  1      0.6620000              1.0000000        
F   1
  1      1.3970000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: He
data:
HELIUM
S   4
  1    528.5000000              0.0009400        
  2     79.3100000              0.0072140        
  3     18.0500000              0.0359750        
  4      5.0850000              0.1277820        
S   1
  1      1.6090000              1.0000000        
S   1
  1      0.5363000              1.0000000        
S   1
  1      0.1833000              1.0000000        
P   1
  1      5.9940000              1.0000000        
P   1
  1      1.7450000              1.0000000        
P   1
  1      0.5600000              1.0000000        
D   1
  1      4.2990000              1.0000000        
D   1
  1      1.2230000              1.0000000        
F   1
  1      2.6800000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Li
data:
LITHIUM
S   9
  1   6601.0000000              0.0001170        
  2    989.7000000              0.0009110        
  3    225.7000000              0.0047280        
  4     64.2900000              0.0191970        
  5     21.1800000              0.0630470        
  6      7.7240000              0.1632080        
  7      3.0030000              0.3148270        
  8      1.2120000              0.3939360        
  9      0.4930000              0.1969180        
S   9
  1   6601.0000000             -0.0000180        
  2    989.7000000             -0.0001420        
  3    225.7000000             -0.0007410        
  4     64.2900000             -0.0030200        
  5     21.1800000             -0.0101230        
  6      7.7240000             -0.0270940        
  7      3.0030000             -0.0573590        
  8      1.2120000             -0.0938950        
  9      0.4930000             -0.1210910        
S   1
  1      0.0951500              1.0000000        
S   1
  1      0.0479100              1.0000000        
S   1
  1      0.0222000              1.0000000        
S   1
  1      0.0063600              1.0000000        
P   3
  1      6.2500000              0.0033880        
  2      1.3700000              0.0193160        
  3      0.3672000              0.0791040        
P   1
  1      0.1192000              1.0000000        
P   1
  1      0.0447400              1.0000000        
P   1
  1      0.0179500              1.0000000        
P   1
  1      0.0075600              1.0000000        
D   1
  1      0.3440000              1.0000000        
D   1
  1      0.1530000              1.0000000        
D   1
  1      0.0680000              1.0000000        
F   1
  1      0.2460000              1.0000000        
F   1
  1      0.1292000              1.0000000        
G   1
  1      0.2380000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Be
data:
BERYLLIUM
S   9
  1  14630.0000000              0.0000920        
  2   2191.0000000              0.0007130        
  3    498.2000000              0.0037350        
  4    140.9000000              0.0154680        
  5     45.8600000              0.0528740        
  6     16.4700000              0.1456940        
  7      6.3190000              0.3026810        
  8      2.5350000              0.4049360        
  9      1.0350000              0.2223870        
S   9
  1  14630.0000000             -0.0000170        
  2   2191.0000000             -0.0001300        
  3    498.2000000             -0.0006790        
  4    140.9000000             -0.0028570        
  5     45.8600000             -0.0098130        
  6     16.4700000             -0.0286090        
  7      6.3190000             -0.0637600        
  8      2.5350000             -0.1172310        
  9      1.0350000             -0.1212020        
S   1
  1      0.2528000              1.0000000        
S   1
  1      0.1052000              1.0000000        
S   1
  1      0.0426100              1.0000000        
S   1
  1      0.0143900              1.0000000        
P   3
  1     14.0300000              0.0040990        
  2      3.1680000              0.0256260        
  3      0.9024000              0.1037680        
P   1
  1      0.3036000              1.0000000        
P   1
  1      0.1130000              1.0000000        
P   1
  1      0.0428600              1.0000000        
P   1
  1      0.0065000              1.0000000        
D   1
  1      1.0720000              1.0000000        
D   1
  1      0.4410000              1.0000000        
D   1
  1      0.1811000              1.0000000        
F   1
  1      0.4810000              1.0000000        
F   1
  1      0.2550000              1.0000000        
G   1
  1      0.4150000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: B
data:
BORON
S   9
  1  23870.0000000              0.0000880        
  2   3575.0000000              0.0006870        
  3    812.8000000              0.0036000        
  4    229.7000000              0.0149490        
  5     74.6900000              0.0514350        
  6     26.8100000              0.1433020        
  7     10.3200000              0.3009350        
  8      4.1780000              0.4035260        
  9      1.7270000              0.2253400        
S   9
  1  23870.0000000             -0.0000180        
  2   3575.0000000             -0.0001390        
  3    812.8000000             -0.0007250        
  4    229.7000000             -0.0030630        
  5     74.6900000             -0.0105810        
  6     26.8100000             -0.0313650        
  7     10.3200000             -0.0710120        
  8      4.1780000             -0.1321030        
  9      1.7270000             -0.1230720        
S   1
  1      0.4704000              1.0000000        
S   1
  1      0.1896000              1.0000000        
S   1
  1      0.0739400              1.0000000        
S   1
  1      0.0272100              1.0000000        
P   3
  1     22.2600000              0.0050950        
  2      5.0580000              0.0332060        
  3      1.4870000              0.1323140        
P   1
  1      0.5071000              1.0000000        
P   1
  1      0.1812000              1.0000000        
P   1
  1      0.0646300              1.0000000        
P   1
  1      0.0187800              1.0000000        
D   1
  1      1.1100000              1.0000000        
D   1
  1      0.4020000              1.0000000        
D   1
  1      0.1450000              1.0000000        
F   1
  1      0.8820000              1.0000000        
F   1
  1      0.3110000              1.0000000        
G   1
  1      0.6730000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: C
data:
CARBON
S   9
  1  33980.0000000              0.0000910        
  2   5089.0000000              0.0007040        
  3   1157.0000000              0.0036930        
  4    326.6000000              0.0153600        
  5    106.1000000              0.0529290        
  6     38.1100000              0.1470430        
  7     14.7500000              0.3056310        
  8      6.0350000              0.3993450        
  9      2.5300000              0.2170510        
S   9
  1  33980.0000000             -0.0000190        
  2   5089.0000000             -0.0001510        
  3   1157.0000000             -0.0007850        
  4    326.6000000             -0.0033240        
  5    106.1000000             -0.0115120        
  6     38.1100000             -0.0341600        
  7     14.7500000             -0.0771730        
  8      6.0350000             -0.1414930        
  9      2.5300000             -0.1180190        
S   1
  1      0.7355000              1.0000000        
S   1
  1      0.2905000              1.0000000        
S   1
  1      0.1111000              1.0000000        
S   1
  1      0.0414500              1.0000000        
P   3
  1     34.5100000              0.0053780        
  2      7.9150000              0.0361320        
  3      2.3680000              0.1424930        
P   1
  1      0.8132000              1.0000000        
P   1
  1      0.2890000              1.0000000        
P   1
  1      0.1007000              1.0000000        
P   1
  1      0.0321800              1.0000000        
D   1
  1      1.8480000              1.0000000        
D   1
  1      0.6490000              1.0000000        
D   1
  1      0.2280000              1.0000000        
F   1
  1      1.4190000              1.0000000        
F   1
  1      0.4850000              1.0000000        
G   1
  1      1.0110000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: N
data:
NITROGEN
S   9
  1  45840.0000000              0.0000920        
  2   6868.0000000              0.0007170        
  3   1563.0000000              0.0037490        
  4    442.4000000              0.0155320        
  5    144.3000000              0.0531460        
  6     52.1800000              0.1467870        
  7     20.3400000              0.3046630        
  8      8.3810000              0.3976840        
  9      3.5290000              0.2176410        
S   9
  1  45840.0000000             -0.0000200        
  2   6868.0000000             -0.0001590        
  3   1563.0000000             -0.0008240        
  4    442.4000000             -0.0034780        
  5    144.3000000             -0.0119660        
  6     52.1800000             -0.0353880        
  7     20.3400000             -0.0800770        
  8      8.3810000             -0.1467220        
  9      3.5290000             -0.1163600        
S   1
  1      1.0540000              1.0000000        
S   1
  1      0.4118000              1.0000000        
S   1
  1      0.1552000              1.0000000        
S   1
  1      0.0546400              1.0000000        
P   3
  1     49.3300000              0.0055330        
  2     11.3700000              0.0379620        
  3      3.4350000              0.1490280        
P   1
  1      1.1820000              1.0000000        
P   1
  1      0.4173000              1.0000000        
P   1
  1      0.1428000              1.0000000        
P   1
  1      0.0440200              1.0000000        
D   1
  1      2.8370000              1.0000000        
D   1
  1      0.9680000              1.0000000        
D   1
  1      0.3350000              1.0000000        
F   1
  1      2.0270000              1.0000000        
F   1
  1      0.6850000              1.0000000        
G   1
  1      1.4270000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: O
data:
OXYGEN
S   9
  1  61420.0000000              0.0000900        
  2   9199.0000000              0.0006980        
  3   2091.0000000              0.0036640        
  4    590.9000000              0.0152180        
  5    192.3000000              0.0524230        
  6     69.3200000              0.1459210        
  7     26.9700000              0.3052580        
  8     11.1000000              0.3985080        
  9      4.6820000              0.2169800        
S   9
  1  61420.0000000             -0.0000200        
  2   9199.0000000             -0.0001590        
  3   2091.0000000             -0.0008290        
  4    590.9000000             -0.0035080        
  5    192.3000000             -0.0121560        
  6     69.3200000             -0.0362610        
  7     26.9700000             -0.0829920        
  8     11.1000000             -0.1520900        
  9      4.6820000             -0.1153310        
S   1
  1      1.4280000              1.0000000        
S   1
  1      0.5547000              1.0000000        
S   1
  1      0.2067000              1.0000000        
S   1
  1      0.0695900              1.0000000        
P   3
  1     63.4200000              0.0060440        
  2     14.6600000              0.0417990        
  3      4.4590000              0.1611430        
P   1
  1      1.5310000              1.0000000        
P   1
  1      0.5302000              1.0000000        
P   1
  1      0.1750000              1.0000000        
P   1
  1      0.0534800              1.0000000        
D   1
  1      3.7750000              1.0000000        
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.4440000              1.0000000        
F   1
  1      2.6660000              1.0000000        
F   1
  1      0.8590000              1.0000000        
G   1
  1      1.8460000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: F
data:
FLUORINE
S   9
  1  74530.0000000              0.0000950        
  2  11170.0000000              0.0007380        
  3   2543.0000000              0.0038580        
  4    721.0000000              0.0159260        
  5    235.9000000              0.0542890        
  6     85.6000000              0.1495130        
  7     33.5500000              0.3082520        
  8     13.9300000              0.3948530        
  9      5.9150000              0.2110310        
S   9
  1  74530.0000000             -0.0000220        
  2  11170.0000000             -0.0001720        
  3   2543.0000000             -0.0008910        
  4    721.0000000             -0.0037480        
  5    235.9000000             -0.0128620        
  6     85.6000000             -0.0380610        
  7     33.5500000             -0.0862390        
  8     13.9300000             -0.1558650        
  9      5.9150000             -0.1109140        
S   1
  1      1.8430000              1.0000000        
S   1
  1      0.7124000              1.0000000        
S   1
  1      0.2637000              1.0000000        
S   1
  1      0.0859400              1.0000000        
P   3
  1     80.3900000              0.0063470        
  2     18.6300000              0.0442040        
  3      5.6940000              0.1685140        
P   1
  1      1.9530000              1.0000000        
P   1
  1      0.6702000              1.0000000        
P   1
  1      0.2166000              1.0000000        
P   1
  1      0.0656800              1.0000000        
D   1
  1      5.0140000              1.0000000        
D   1
  1      1.7250000              1.0000000        
D   1
  1      0.5860000              1.0000000        
F   1
  1      3.5620000              1.0000000        
F   1
  1      1.1480000              1.0000000        
G   1
  1      2.3760000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Ne
data:
NEON
S   9
  1  99920.0000000              0.0000860        
  2  14960.0000000              0.0006690        
  3   3399.0000000              0.0035180        
  4    958.9000000              0.0146670        
  5    311.2000000              0.0509620        
  6    111.7000000              0.1437440        
  7     43.3200000              0.3045620        
  8     17.8000000              0.4001050        
  9      7.5030000              0.2186440        
S   9
  1  99920.0000000             -0.0000200        
  2  14960.0000000             -0.0001580        
  3   3399.0000000             -0.0008240        
  4    958.9000000             -0.0035000        
  5    311.2000000             -0.0122330        
  6    111.7000000             -0.0370170        
  7     43.3200000             -0.0861130        
  8     17.8000000             -0.1583810        
  9      7.5030000             -0.1142880        
S   1
  1      2.3370000              1.0000000        
S   1
  1      0.9001000              1.0000000        
S   1
  1      0.3301000              1.0000000        
S   1
  1      0.1054000              1.0000000        
P   3
  1     99.6800000              0.0065660        
  2     23.1500000              0.0459790        
  3      7.1080000              0.1734190        
P   1
  1      2.4410000              1.0000000        
P   1
  1      0.8339000              1.0000000        
P   1
  1      0.2662000              1.0000000        
P   1
  1      0.0817800              1.0000000        
D   1
  1      6.4710000              1.0000000        
D   1
  1      2.2130000              1.0000000        
D   1
  1      0.7470000              1.0000000        
F   1
  1      4.6570000              1.0000000        
F   1
  1      1.5240000              1.0000000        
G   1
  1      2.9830000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Na
data:
SODIUM
S   16
  1 1224000.0000000             0.478894D-05     
  2 183200.0000000              0.372395D-04     
  3  41700.0000000              0.195831D-03     
  4  11810.0000000              0.826698D-03     
  5   3853.0000000              0.300251D-02     
  6   1391.0000000              0.970310D-02     
  7    542.5000000              0.282337D-01     
  8    224.9000000              0.732058D-01     
  9     97.9300000              0.162897D+00     
 10     44.3100000              0.288708D+00     
 11     20.6500000              0.346829D+00     
 12      9.7290000              0.206865D+00     
 13      4.2280000              0.328009D-01     
 14      1.9690000             -0.647736D-03     
 15      0.8890000              0.145878D-02     
 16      0.3964000             -0.178346D-03     
S   16
  1 1224000.0000000            -0.116958D-05     
  2 183200.0000000             -0.909110D-05     
  3  41700.0000000             -0.478499D-04     
  4  11810.0000000             -0.201962D-03     
  5   3853.0000000             -0.735837D-03     
  6   1391.0000000             -0.238746D-02     
  7    542.5000000             -0.704969D-02     
  8    224.9000000             -0.187856D-01     
  9     97.9300000             -0.446153D-01     
 10     44.3100000             -0.897741D-01     
 11     20.6500000             -0.142940D+00     
 12      9.7290000             -0.124315D+00     
 13      4.2280000              0.999648D-01     
 14      1.9690000              0.417080D+00     
 15      0.8890000              0.475123D+00     
 16      0.3964000              0.163268D+00     
S   16
  1 1224000.0000000             0.175871D-06     
  2 183200.0000000              0.136594D-05     
  3  41700.0000000              0.719795D-05     
  4  11810.0000000              0.303349D-04     
  5   3853.0000000              0.110752D-03     
  6   1391.0000000              0.358596D-03     
  7    542.5000000              0.106272D-02     
  8    224.9000000              0.282687D-02     
  9     97.9300000              0.676742D-02     
 10     44.3100000              0.136480D-01     
 11     20.6500000              0.222814D-01     
 12      9.7290000              0.196011D-01     
 13      4.2280000             -0.167708D-01     
 14      1.9690000             -0.773734D-01     
 15      0.8890000             -0.113501D+00     
 16      0.3964000             -0.139130D+00     
S   1
  1      0.0699300              1.0000000        
S   1
  1      0.0328900              1.0000000        
S   1
  1      0.0161200              1.0000000        
S   1
  1      0.0050300              1.0000000        
P   9
  1    413.4000000              0.908196D-03     
  2     97.9800000              0.741773D-02     
  3     31.3700000              0.357464D-01     
  4     11.6200000              0.118520D+00     
  5      4.6710000              0.261403D+00     
  6      1.9180000              0.378395D+00     
  7      0.7775000              0.334632D+00     
  8      0.3013000              0.126844D+00     
  9      0.2275000             -0.147117D-01     
P   9
  1    413.4000000             -0.901741D-04     
  2     97.9800000             -0.739342D-03     
  3     31.3700000             -0.357309D-02     
  4     11.6200000             -0.120142D-01     
  5      4.6710000             -0.267178D-01     
  6      1.9180000             -0.392753D-01     
  7      0.7775000             -0.376083D-01     
  8      0.3013000             -0.433228D-01     
  9      0.2275000              0.518003D-01     
P   1
  1      0.0752700              1.0000000        
P   1
  1      0.0312600              1.0000000        
P   1
  1      0.0134200              1.0000000        
P   1
  1      0.0077200              1.0000000        
D   1
  1      0.1538000              1.0000000        
D   1
  1      0.0865000              1.0000000        
D   1
  1      0.0487000              1.0000000        
F   1
  1      0.1912000              1.0000000        
F   1
  1      0.1036000              1.0000000        
G   1
  1      0.1722000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Mg
data:
MAGNESIUM
S   13
  1 327600.0000000              0.309608D-04     
  2  49050.0000000              0.240954D-03     
  3  11150.0000000              0.126660D-02     
  4   3152.0000000              0.533359D-02     
  5   1025.0000000              0.190770D-01     
  6    368.8000000              0.588058D-01     
  7    143.2000000              0.151454D+00     
  8     58.9600000              0.300716D+00     
  9     25.4000000              0.381149D+00     
 10     11.1500000              0.213584D+00     
 11      4.0040000              0.231210D-01     
 12      1.7010000             -0.230757D-02     
 13      0.7060000              0.128900D-02     
S   13
  1 327600.0000000             -0.783173D-05     
  2  49050.0000000             -0.607935D-04     
  3  11150.0000000             -0.321197D-03     
  4   3152.0000000             -0.134955D-02     
  5   1025.0000000             -0.490570D-02     
  6    368.8000000             -0.153561D-01     
  7    143.2000000             -0.423409D-01     
  8     58.9600000             -0.940603D-01     
  9     25.4000000             -0.163425D+00     
 10     11.1500000             -0.124754D+00     
 11      4.0040000              0.235623D+00     
 12      1.7010000              0.577563D+00     
 13      0.7060000              0.335232D+00     
S   13
  1 327600.0000000              0.150908D-05     
  2  49050.0000000              0.117134D-04     
  3  11150.0000000              0.618980D-04     
  4   3152.0000000              0.260088D-03     
  5   1025.0000000              0.946218D-03     
  6    368.8000000              0.296595D-02     
  7    143.2000000              0.821245D-02     
  8     58.9600000              0.183977D-01     
  9     25.4000000              0.326657D-01     
 10     11.1500000              0.257315D-01     
 11      4.0040000             -0.535351D-01     
 12      1.7010000             -0.156895D+00     
 13      0.7060000             -0.206659D+00     
S   1
  1      0.1410000              1.0000000        
S   1
  1      0.0680800              1.0000000        
S   1
  1      0.0306300              1.0000000        
S   1
  1      0.0123900              1.0000000        
P   9
  1    539.6000000              0.833969D-03     
  2    127.9000000              0.689215D-02     
  3     41.0200000              0.337874D-01     
  4     15.2500000              0.114401D+00     
  5      6.1660000              0.259514D+00     
  6      2.5610000              0.385095D+00     
  7      1.0600000              0.335373D+00     
  8      0.4176000              0.110641D+00     
  9      0.2690000             -0.121315D-01     
P   9
  1    539.6000000             -0.132076D-03     
  2    127.9000000             -0.109538D-02     
  3     41.0200000             -0.539495D-02     
  4     15.2500000             -0.185572D-01     
  5      6.1660000             -0.427375D-01     
  6      2.5610000             -0.647684D-01     
  7      1.0600000             -0.627818D-01     
  8      0.4176000             -0.244912D-01     
  9      0.2690000              0.104761D+00     
P   1
  1      0.1223000              1.0000000        
P   1
  1      0.0547600              1.0000000        
P   1
  1      0.0238800              1.0000000        
P   1
  1      0.0070600              1.0000000        
D   1
  1      0.1060000              1.0000000        
D   1
  1      0.1944000              1.0000000        
D   1
  1      0.3570000              1.0000000        
F   1
  1      0.1810000              1.0000000        
F   1
  1      0.3590000              1.0000000        
G   1
  1      0.3070000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Al
data:
ALUMINUM
S   13
  1 419600.0000000              0.278219D-04     
  2  62830.0000000              0.216330D-03     
  3  14290.0000000              0.113754D-02     
  4   4038.0000000              0.479635D-02     
  5   1312.0000000              0.172389D-01     
  6    470.5000000              0.538066D-01     
  7    181.8000000              0.141326D+00     
  8     74.4600000              0.289268D+00     
  9     31.9000000              0.384825D+00     
 10     13.9600000              0.232852D+00     
 11      5.1800000              0.293330D-01     
 12      2.2650000             -0.300574D-02     
 13      0.9664000              0.166673D-02     
S   13
  1 419600.0000000             -0.723754D-05     
  2  62830.0000000             -0.561733D-04     
  3  14290.0000000             -0.296528D-03     
  4   4038.0000000             -0.124913D-02     
  5   1312.0000000             -0.455101D-02     
  6    470.5000000             -0.144393D-01     
  7    181.8000000             -0.403464D-01     
  8     74.4600000             -0.922618D-01     
  9     31.9000000             -0.164510D+00     
 10     13.9600000             -0.141296D+00     
 11      5.1800000              0.195365D+00     
 12      2.2650000              0.572475D+00     
 13      0.9664000              0.374041D+00     
S   13
  1 419600.0000000              0.167150D-05     
  2  62830.0000000              0.129641D-04     
  3  14290.0000000              0.685101D-04     
  4   4038.0000000              0.288274D-03     
  5   1312.0000000              0.105276D-02     
  6    470.5000000              0.333878D-02     
  7    181.8000000              0.939217D-02     
  8     74.4600000              0.216047D-01     
  9     31.9000000              0.395873D-01     
 10     13.9600000              0.349180D-01     
 11      5.1800000             -0.528415D-01     
 12      2.2650000             -0.191878D+00     
 13      0.9664000             -0.254115D+00     
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1184000              1.0000000        
S   1
  1      0.0502100              1.0000000        
S   1
  1      0.0183000              1.0000000        
P   8
  1    891.3000000              0.491755D-03     
  2    211.3000000              0.415843D-02     
  3     68.2800000              0.212538D-01     
  4     25.7000000              0.764058D-01     
  5     10.6300000              0.194277D+00     
  6      4.6020000              0.334428D+00     
  7      2.0150000              0.375026D+00     
  8      0.8706000              0.204041D+00     
P   8
  1    891.3000000             -0.888695D-04     
  2    211.3000000             -0.745823D-03     
  3     68.2800000             -0.387025D-02     
  4     25.7000000             -0.139350D-01     
  5     10.6300000             -0.366860D-01     
  6      4.6020000             -0.627797D-01     
  7      2.0150000             -0.789602D-01     
  8      0.8706000             -0.288589D-01     
P   1
  1      0.2972000              1.0000000        
P   1
  1      0.1100000              1.0000000        
P   1
  1      0.0398900              1.0000000        
P   1
  1      0.0121000              1.0000000        
D   1
  1      1.9700000              1.0000000        
D   1
  1      0.4370000              1.0000000        
D   1
  1      0.1950000              1.0000000        
D   1
  1      0.0800000              1.0000000        
F   1
  1      0.1540000              1.0000000        
F   1
  1      0.4010000              1.0000000        
G   1
  1      0.3570000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Si
data:
SILICON
S   13
  1 513000.0000000              0.260920D-04     
  2  76820.0000000              0.202905D-03     
  3  17470.0000000              0.106715D-02     
  4   4935.0000000              0.450597D-02     
  5   1602.0000000              0.162359D-01     
  6    574.1000000              0.508913D-01     
  7    221.5000000              0.135155D+00     
  8     90.5400000              0.281292D+00     
  9     38.7400000              0.385336D+00     
 10     16.9500000              0.245651D+00     
 11      6.4520000              0.343145D-01     
 12      2.8740000             -0.334884D-02     
 13      1.2500000              0.187625D-02     
S   13
  1 513000.0000000             -0.694880D-05     
  2  76820.0000000             -0.539641D-04     
  3  17470.0000000             -0.284716D-03     
  4   4935.0000000             -0.120203D-02     
  5   1602.0000000             -0.438397D-02     
  6    574.1000000             -0.139776D-01     
  7    221.5000000             -0.393516D-01     
  8     90.5400000             -0.914283D-01     
  9     38.7400000             -0.165609D+00     
 10     16.9500000             -0.152505D+00     
 11      6.4520000              0.168524D+00     
 12      2.8740000              0.569284D+00     
 13      1.2500000              0.398056D+00     
S   13
  1 513000.0000000              0.178068D-05     
  2  76820.0000000              0.138148D-04     
  3  17470.0000000              0.730005D-04     
  4   4935.0000000              0.307666D-03     
  5   1602.0000000              0.112563D-02     
  6    574.1000000              0.358435D-02     
  7    221.5000000              0.101728D-01     
  8     90.5400000              0.237520D-01     
  9     38.7400000              0.443483D-01     
 10     16.9500000              0.419041D-01     
 11      6.4520000             -0.502504D-01     
 12      2.8740000             -0.216578D+00     
 13      1.2500000             -0.286448D+00     
S   1
  1      0.3599000              1.0000000        
S   1
  1      0.1699000              1.0000000        
S   1
  1      0.0706600              1.0000000        
S   1
  1      0.0275000              1.0000000        
P   8
  1   1122.0000000              0.448143D-03     
  2    266.0000000              0.381639D-02     
  3     85.9200000              0.198105D-01     
  4     32.3300000              0.727017D-01     
  5     13.3700000              0.189839D+00     
  6      5.8000000              0.335672D+00     
  7      2.5590000              0.379365D+00     
  8      1.1240000              0.201193D+00     
P   8
  1   1122.0000000             -0.964883D-04     
  2    266.0000000             -0.811971D-03     
  3     85.9200000             -0.430087D-02     
  4     32.3300000             -0.157502D-01     
  5     13.3700000             -0.429541D-01     
  6      5.8000000             -0.752574D-01     
  7      2.5590000             -0.971446D-01     
  8      1.1240000             -0.227507D-01     
P   1
  1      0.3988000              1.0000000        
P   1
  1      0.1533000              1.0000000        
P   1
  1      0.0572800              1.0000000        
P   1
  1      0.0200000              1.0000000        
D   1
  1      2.6450000              1.0000000        
D   1
  1      0.6080000              1.0000000        
D   1
  1      0.2720000              1.0000000        
D   1
  1      0.1130000              1.0000000        
F   1
  1      0.2120000              1.0000000        
F   1
  1      0.5410000              1.0000000        
G   1
  1      0.4610000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: P
data:
PHOSPHOROUS
S   13
  1 615200.0000000              0.247450D-04     
  2  92120.0000000              0.192465D-03     
  3  20950.0000000              0.101202D-02     
  4   5920.0000000              0.427261D-02     
  5   1922.0000000              0.154161D-01     
  6    688.0000000              0.485976D-01     
  7    265.0000000              0.130060D+00     
  8    108.2000000              0.274514D+00     
  9     46.2200000              0.385402D+00     
 10     20.2300000              0.255934D+00     
 11      7.8590000              0.391237D-01     
 12      3.5470000             -0.368010D-02     
 13      1.5640000              0.208211D-02     
S   13
  1 615200.0000000             -0.672205D-05     
  2  92120.0000000             -0.522311D-04     
  3  20950.0000000             -0.275361D-03     
  4   5920.0000000             -0.116307D-02     
  5   1922.0000000             -0.424281D-02     
  6    688.0000000             -0.136114D-01     
  7    265.0000000             -0.385114D-01     
  8    108.2000000             -0.906643D-01     
  9     46.2200000             -0.166584D+00     
 10     20.2300000             -0.161447D+00     
 11      7.8590000              0.146781D+00     
 12      3.5470000              0.566682D+00     
 13      1.5640000              0.416433D+00     
S   13
  1 615200.0000000              0.184740D-05     
  2  92120.0000000              0.143380D-04     
  3  20950.0000000              0.757228D-04     
  4   5920.0000000              0.319205D-03     
  5   1922.0000000              0.116851D-02     
  6    688.0000000              0.374267D-02     
  7    265.0000000              0.106817D-01     
  8    108.2000000              0.252657D-01     
  9     46.2200000              0.479283D-01     
 10     20.2300000              0.477096D-01     
 11      7.8590000             -0.466525D-01     
 12      3.5470000             -0.234968D+00     
 13      1.5640000             -0.311337D+00     
S   1
  1      0.4888000              1.0000000        
S   1
  1      0.2266000              1.0000000        
S   1
  1      0.0933100              1.0000000        
S   1
  1      0.0354000              1.0000000        
P   8
  1   1367.0000000              0.421015D-03     
  2    324.0000000              0.360985D-02     
  3    104.6000000              0.189217D-01     
  4     39.3700000              0.705560D-01     
  5     16.2600000              0.188157D+00     
  6      7.0560000              0.338709D+00     
  7      3.1300000              0.381943D+00     
  8      1.3940000              0.195261D+00     
P   8
  1   1367.0000000             -0.100827D-03     
  2    324.0000000             -0.854499D-03     
  3    104.6000000             -0.457116D-02     
  4     39.3700000             -0.170327D-01     
  5     16.2600000             -0.475204D-01     
  6      7.0560000             -0.852786D-01     
  7      3.1300000             -0.109676D+00     
  8      1.3940000             -0.161181D-01     
P   1
  1      0.5179000              1.0000000        
P   1
  1      0.2032000              1.0000000        
P   1
  1      0.0769800              1.0000000        
P   1
  1      0.0272000              1.0000000        
D   1
  1      3.3430000              1.0000000        
D   1
  1      0.8070000              1.0000000        
D   1
  1      0.3650000              1.0000000        
D   1
  1      0.1540000              1.0000000        
F   1
  1      0.2800000              1.0000000        
F   1
  1      0.7030000              1.0000000        
G   1
  1      0.5970000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: S
data:
SULFUR
S   13
  1 727800.0000000              0.236025D-04     
  2 109000.0000000              0.183482D-03     
  3  24800.0000000              0.964278D-03     
  4   7014.0000000              0.406537D-02     
  5   2278.0000000              0.146973D-01     
  6    814.7000000              0.465081D-01     
  7    313.4000000              0.125508D+00     
  8    127.7000000              0.268433D+00     
  9     54.4800000              0.384809D+00     
 10     23.8500000              0.265372D+00     
 11      9.4280000              0.437326D-01     
 12      4.2900000             -0.378807D-02     
 13      1.9090000              0.218083D-02     
S   13
  1 727800.0000000             -0.652179D-05     
  2 109000.0000000             -0.506631D-04     
  3  24800.0000000             -0.266833D-03     
  4   7014.0000000             -0.112601D-02     
  5   2278.0000000             -0.411186D-02     
  6    814.7000000             -0.132454D-01     
  7    313.4000000             -0.377004D-01     
  8    127.7000000             -0.898554D-01     
  9     54.4800000             -0.167098D+00     
 10     23.8500000             -0.169354D+00     
 11      9.4280000              0.127824D+00     
 12      4.2900000              0.564862D+00     
 13      1.9090000              0.431767D+00     
S   13
  1 727800.0000000              0.189406D-05     
  2 109000.0000000              0.146948D-04     
  3  24800.0000000              0.775460D-04     
  4   7014.0000000              0.326509D-03     
  5   2278.0000000              0.119686D-02     
  6    814.7000000              0.384799D-02     
  7    313.4000000              0.110539D-01     
  8    127.7000000              0.264645D-01     
  9     54.4800000              0.508771D-01     
 10     23.8500000              0.530030D-01     
 11      9.4280000             -0.425518D-01     
 12      4.2900000             -0.250853D+00     
 13      1.9090000             -0.333152D+00     
S   1
  1      0.6270000              1.0000000        
S   1
  1      0.2873000              1.0000000        
S   1
  1      0.1172000              1.0000000        
S   1
  1      0.0428000              1.0000000        
P   8
  1   1546.0000000              0.441183D-03     
  2    366.4000000              0.377571D-02     
  3    118.4000000              0.198360D-01     
  4     44.5300000              0.742063D-01     
  5     18.3800000              0.197327D+00     
  6      7.9650000              0.351851D+00     
  7      3.5410000              0.378687D+00     
  8      1.5910000              0.170931D+00     
P   8
  1   1546.0000000             -0.113110D-03     
  2    366.4000000             -0.958581D-03     
  3    118.4000000             -0.513471D-02     
  4     44.5300000             -0.192641D-01     
  5     18.3800000             -0.535980D-01     
  6      7.9650000             -0.960333D-01     
  7      3.5410000             -0.118183D+00     
  8      1.5910000              0.923194D-02     
P   1
  1      0.6205000              1.0000000        
P   1
  1      0.2420000              1.0000000        
P   1
  1      0.0901400              1.0000000        
P   1
  1      0.0317000              1.0000000        
D   1
  1      4.1590000              1.0000000        
D   1
  1      1.0190000              1.0000000        
D   1
  1      0.4640000              1.0000000        
D   1
  1      0.1940000              1.0000000        
F   1
  1      0.3350000              1.0000000        
F   1
  1      0.8690000              1.0000000        
G   1
  1      0.6830000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Cl
data:
CHLORINE
S   13
  1 834900.0000000              0.231688D-04     
  2 125000.0000000              0.180154D-03     
  3  28430.0000000              0.947782D-03     
  4   8033.0000000              0.400139D-02     
  5   2608.0000000              0.144629D-01     
  6    933.9000000              0.456586D-01     
  7    360.0000000              0.123248D+00     
  8    147.0000000              0.264369D+00     
  9     62.8800000              0.382989D+00     
 10     27.6000000              0.270934D+00     
 11     11.0800000              0.471404D-01     
 12      5.0750000             -0.371766D-02     
 13      2.2780000              0.219158D-02     
S   13
  1 834900.0000000             -0.649649D-05     
  2 125000.0000000             -0.504895D-04     
  3  28430.0000000             -0.266113D-03     
  4   8033.0000000             -0.112499D-02     
  5   2608.0000000             -0.410497D-02     
  6    933.9000000             -0.131987D-01     
  7    360.0000000             -0.375342D-01     
  8    147.0000000             -0.897233D-01     
  9     62.8800000             -0.167671D+00     
 10     27.6000000             -0.174763D+00     
 11     11.0800000              0.114909D+00     
 12      5.0750000              0.563618D+00     
 13      2.2780000              0.441606D+00     
S   13
  1 834900.0000000              0.196645D-05     
  2 125000.0000000              0.152620D-04     
  3  28430.0000000              0.806086D-04     
  4   8033.0000000              0.339960D-03     
  5   2608.0000000              0.124551D-02     
  6    933.9000000              0.399612D-02     
  7    360.0000000              0.114751D-01     
  8    147.0000000              0.275504D-01     
  9     62.8800000              0.532917D-01     
 10     27.6000000              0.571246D-01     
 11     11.0800000             -0.395201D-01     
 12      5.0750000             -0.264343D+00     
 13      2.2780000             -0.349291D+00     
S   1
  1      0.7775000              1.0000000        
S   1
  1      0.3527000              1.0000000        
S   1
  1      0.1431000              1.0000000        
S   1
  1      0.0519000              1.0000000        
P   8
  1   1703.0000000              0.474039D-03     
  2    403.6000000              0.406412D-02     
  3    130.3000000              0.213355D-01     
  4     49.0500000              0.794611D-01     
  5     20.2600000              0.208927D+00     
  6      8.7870000              0.364945D+00     
  7      3.9190000              0.371725D+00     
  8      1.7650000              0.146292D+00     
P   8
  1   1703.0000000             -0.128266D-03     
  2    403.6000000             -0.109356D-02     
  3    130.3000000             -0.583429D-02     
  4     49.0500000             -0.219258D-01     
  5     20.2600000             -0.601385D-01     
  6      8.7870000             -0.106929D+00     
  7      3.9190000             -0.122454D+00     
  8      1.7650000              0.383619D-01     
P   1
  1      0.7207000              1.0000000        
P   1
  1      0.2839000              1.0000000        
P   1
  1      0.1060000              1.0000000        
P   1
  1      0.0376000              1.0000000        
D   1
  1      5.1910000              1.0000000        
D   1
  1      1.2760000              1.0000000        
D   1
  1      0.5830000              1.0000000        
D   1
  1      0.2430000              1.0000000        
F   1
  1      0.4230000              1.0000000        
F   1
  1      1.0890000              1.0000000        
G   1
  1      0.8270000              1.0000000        


name: apr-cc-pV(Q+d)Z
description: apr-cc-pV(Q+d)Z basis set is a partially augmented cc-pV(Q+d)Z basis set of Dunning and coworkers.
elt: Ar
data:
ARGON
S   13
  1 950600.0000000              0.227545D-04     
  2 142300.0000000              0.176945D-03     
  3  32360.0000000              0.931282D-03     
  4   9145.0000000              0.392860D-02     
  5   2970.0000000              0.142064D-01     
  6   1064.0000000              0.448114D-01     
  7    410.8000000              0.121001D+00     
  8    168.0000000              0.260579D+00     
  9     71.9900000              0.381364D+00     
 10     31.6700000              0.276058D+00     
 11     12.8900000              0.505179D-01     
 12      5.9290000             -0.359866D-02     
 13      2.6780000              0.218798D-02     
S   13
  1 950600.0000000             -0.646201D-05     
  2 142300.0000000             -0.502346D-04     
  3  32360.0000000             -0.264804D-03     
  4   9145.0000000             -0.111895D-02     
  5   2970.0000000             -0.408276D-02     
  6   1064.0000000             -0.131216D-01     
  7    410.8000000             -0.372855D-01     
  8    168.0000000             -0.894709D-01     
  9     71.9900000             -0.168054D+00     
 10     31.6700000             -0.179594D+00     
 11     12.8900000              0.102953D+00     
 12      5.9290000              0.562630D+00     
 13      2.6780000              0.450355D+00     
S   13
  1 950600.0000000              0.202056D-05     
  2 142300.0000000              0.156851D-04     
  3  32360.0000000              0.828617D-04     
  4   9145.0000000              0.349264D-03     
  5   2970.0000000              0.127976D-02     
  6   1064.0000000              0.410365D-02     
  7    410.8000000              0.117789D-01     
  8    168.0000000              0.283868D-01     
  9     71.9900000              0.552406D-01     
 10     31.6700000              0.607492D-01     
 11     12.8900000             -0.362012D-01     
 12      5.9290000             -0.275398D+00     
 13      2.6780000             -0.362845D+00     
S   1
  1      0.9416000              1.0000000        
S   1
  1      0.4239000              1.0000000        
S   1
  1      0.1714000              1.0000000        
S   1
  1      0.0610000              1.0000000        
P   8
  1   1890.0000000              0.495752D-03     
  2    447.8000000              0.425172D-02     
  3    144.6000000              0.223277D-01     
  4     54.4600000              0.830878D-01     
  5     22.5100000              0.217110D+00     
  6      9.7740000              0.374507D+00     
  7      4.3680000              0.366445D+00     
  8      1.9590000              0.129245D+00     
P   8
  1   1890.0000000             -0.138863D-03     
  2    447.8000000             -0.118870D-02     
  3    144.6000000             -0.632553D-02     
  4     54.4600000             -0.238813D-01     
  5     22.5100000             -0.649238D-01     
  6      9.7740000             -0.115444D+00     
  7      4.3680000             -0.123651D+00     
  8      1.9590000              0.649055D-01     
P   1
  1      0.8260000              1.0000000        
P   1
  1      0.3297000              1.0000000        
P   1
  1      0.1242000              1.0000000        
P   1
  1      0.0435000              1.0000000        
D   1
  1      6.3150000              1.0000000        
D   1
  1      1.5620000              1.0000000        
D   1
  1      0.7150000              1.0000000        
D   1
  1      0.2970000              1.0000000        
F   1
  1      0.5430000              1.0000000        
F   1
  1      1.3250000              1.0000000        
G   1
  1      1.0070000              1.0000000        


name: aug-cc-pCV(T+d)Z
description: Core-valence basis sets for second-row atoms (Al-Ar)
elt: Al
data:
ALUMINUM
S   13
  1 205500.0000000              6.7883600E-05    
  2  30780.0000000              5.2714900E-04    
  3   7006.0000000              2.7620300E-03    
  4   1985.0000000              1.1472800E-02    
  5    649.1000000              3.9818800E-02    
  6    235.0000000              1.1504000E-01    
  7     91.6200000              2.6088700E-01    
  8     37.6700000              3.9638600E-01    
  9     15.9100000              2.8459700E-01    
 10      5.8500000              4.4458300E-02    
 11      2.5420000             -4.8983800E-03    
 12      1.0570000              2.6125300E-03    
 13      0.1455000              7.2206800E-04    
S   13
  1 205500.0000000             -1.7637700E-05    
  2  30780.0000000             -1.3719500E-04    
  3   7006.0000000             -7.1891000E-04    
  4   1985.0000000             -3.0114600E-03    
  5    649.1000000             -1.0601400E-02    
  6    235.0000000             -3.2134500E-02    
  7     91.6200000             -8.0315600E-02    
  8     37.6700000             -1.5679400E-01    
  9     15.9100000             -1.6837600E-01    
 10      5.8500000              1.2687900E-01    
 11      2.5420000              5.6149400E-01    
 12      1.0570000              4.3661300E-01    
 13      0.1455000             -1.1456300E-02    
S   13
  1 205500.0000000              4.0731500E-06    
  2  30780.0000000              3.1656600E-05    
  3   7006.0000000              1.6611600E-04    
  4   1985.0000000              6.9499200E-04    
  5    649.1000000              2.4551100E-03    
  6    235.0000000              7.4459800E-03    
  7     91.6200000              1.8825300E-02    
  8     37.6700000              3.7277200E-02    
  9     15.9100000              4.1949600E-02    
 10      5.8500000             -3.5437500E-02    
 11      2.5420000             -1.7513200E-01    
 12      1.0570000             -2.7620300E-01    
 13      0.1455000              6.5280900E-01    
S   1
  1      0.2931000              1.0000000        
S   1
  1      0.0565000              1.0000000        
S   1
  1      0.0221000              1.0000000        
S   1
  1      7.4880000              1.0000000        
S   1
  1      1.2720000              1.0000000        
P   7
  1    444.4000000              1.6278600E-03    
  2    105.1000000              1.3068700E-02    
  3     33.4700000              6.1234100E-02    
  4     12.3300000              1.8787000E-01    
  5      4.8690000              3.6045200E-01    
  6      1.9610000              4.0845400E-01    
  7      0.1888000              9.7651400E-03    
P   7
  1    444.4000000             -2.8634100E-04    
  2    105.1000000             -2.4230800E-03    
  3     33.4700000             -1.0865800E-02    
  4     12.3300000             -3.6430700E-02    
  5      4.8690000             -6.4107400E-02    
  6      1.9610000             -9.7223900E-02    
  7      0.1888000              5.0344800E-01    
P   1
  1      0.7834000              1.0000000        
P   1
  1      0.0555700              1.0000000        
P   1
  1      0.0146000              1.0000000        
P   1
  1      2.2020000              1.0000000        
P   1
  1      5.5480000              1.0000000        
D   1
  1      1.7950000              1.0000000        
D   1
  1      0.3330000              1.0000000        
D   1
  1      0.1110000              1.0000000        
D   1
  1      0.0357000              1.0000000        
D   1
  1      4.9920000              1.0000000        
D   1
  1     13.8830000              1.0000000        
F   1
  1      0.2440000              1.0000000        
F   1
  1      0.0858000              1.0000000        
F   1
  1      5.6860000              1.0000000        


name: aug-cc-pCV(T+d)Z
description: Core-valence basis sets for second-row atoms (Al-Ar)
elt: Si
data:
SILICON
S   13
  1 254900.0000000              6.2510100E-05    
  2  38190.0000000              4.8555300E-04    
  3   8690.0000000              2.5451600E-03    
  4   2462.0000000              1.0586600E-02    
  5    804.8000000              3.6878700E-02    
  6    291.3000000              1.0747900E-01    
  7    113.6000000              2.4793600E-01    
  8     46.7500000              3.9092700E-01    
  9     19.8200000              3.0202600E-01    
 10      7.7080000              5.5923600E-02    
 11      3.3400000             -4.0240600E-03    
 12      1.4020000              2.5803000E-03    
 13      0.2070000              6.0793000E-04    
S   13
  1 254900.0000000             -1.6637000E-05    
  2  38190.0000000             -1.2931000E-04    
  3   8690.0000000             -6.7882800E-04    
  4   2462.0000000             -2.8411700E-03    
  5    804.8000000             -1.0055100E-02    
  6    291.3000000             -3.0577400E-02    
  7    113.6000000             -7.7725600E-02    
  8     46.7500000             -1.5423600E-01    
  9     19.8200000             -1.8036800E-01    
 10      7.7080000              7.9821800E-02    
 11      3.3400000              5.4744100E-01    
 12      1.4020000              4.8011900E-01    
 13      0.2070000             -1.0699600E-02    
S   13
  1 254900.0000000              4.2625700E-06    
  2  38190.0000000              3.3106200E-05    
  3   8690.0000000              1.7401500E-04    
  4   2462.0000000              7.2757400E-04    
  5    804.8000000              2.5833300E-03    
  6    291.3000000              7.8635400E-03    
  7    113.6000000              2.0215500E-02    
  8     46.7500000              4.0732000E-02    
  9     19.8200000              4.9935800E-02    
 10      7.7080000             -2.4939600E-02    
 11      3.3400000             -1.9035000E-01    
 12      1.4020000             -3.1835000E-01    
 13      0.2070000              6.8118000E-01    
S   1
  1      0.4387000              1.0000000        
S   1
  1      0.0794400              1.0000000        
S   1
  1      0.0330000              1.0000000        
S   1
  1      9.1640000              1.0000000        
S   1
  1      1.6210000              1.0000000        
P   7
  1    481.5000000              1.9204500E-03    
  2    113.9000000              1.5355200E-02    
  3     36.2300000              7.1399100E-02    
  4     13.3400000              2.1305200E-01    
  5      5.2520000              3.9035400E-01    
  6      2.1200000              3.9372100E-01    
  7      0.2528000              3.9563000E-03    
P   7
  1    481.5000000             -4.0522000E-04    
  2    113.9000000             -3.3589600E-03    
  3     36.2300000             -1.5286000E-02    
  4     13.3400000             -4.8921800E-02    
  5      5.2520000             -8.5500800E-02    
  6      2.1200000             -1.1213700E-01    
  7      0.2528000              5.5191900E-01    
P   1
  1      0.8561000              1.0000000        
P   1
  1      0.0788900              1.0000000        
P   1
  1      0.0237000              1.0000000        
P   1
  1      6.4580000              1.0000000        
P   1
  1      2.5170000              1.0000000        
D   1
  1      2.2510000              1.0000000        
D   1
  1      0.4760000              1.0000000        
D   1
  1      0.1600000              1.0000000        
D   1
  1      0.0551000              1.0000000        
D   1
  1     16.9990000              1.0000000        
D   1
  1      6.1860000              1.0000000        
F   1
  1      0.3360000              1.0000000        
F   1
  1      0.1250000              1.0000000        
F   1
  1      7.0010000              1.0000000        


name: aug-cc-pCV(T+d)Z
description: Core-valence basis sets for second-row atoms (Al-Ar)
elt: P
data:
PHOSPHOROUS
S   13
  1 312400.0000000              5.7696000E-05    
  2  46800.0000000              4.4829600E-04    
  3  10650.0000000              2.3493900E-03    
  4   3018.0000000              9.7826500E-03    
  5    986.8000000              3.4146700E-02    
  6    357.4000000              1.0020400E-01    
  7    139.6000000              2.3437200E-01    
  8     57.6300000              3.8243400E-01    
  9     24.6000000              3.1808800E-01    
 10     10.1200000              7.0778800E-02    
 11      4.2830000             -1.8179900E-03    
 12      1.8050000              2.1618000E-03    
 13      0.2782000              4.3229700E-04    
S   13
  1 312400.0000000             -1.5670900E-05    
  2  46800.0000000             -1.2172400E-04    
  3  10650.0000000             -6.3967200E-04    
  4   3018.0000000             -2.6742600E-03    
  5    986.8000000             -9.4983100E-03    
  6    357.4000000             -2.8934900E-02    
  7    139.6000000             -7.4512100E-02    
  8     57.6300000             -1.4993800E-01    
  9     24.6000000             -1.8946700E-01    
 10     10.1200000              3.6327000E-02    
 11      4.2830000              5.2881600E-01    
 12      1.8050000              5.1911500E-01    
 13      0.2782000             -9.2569500E-03    
S   13
  1 312400.0000000              4.3063100E-06    
  2  46800.0000000              3.3419400E-05    
  3  10650.0000000              1.7588500E-04    
  4   3018.0000000              7.3434000E-04    
  5    986.8000000              2.6177500E-03    
  6    357.4000000              7.9785200E-03    
  7    139.6000000              2.0794000E-02    
  8     57.6300000              4.2444600E-02    
  9     24.6000000              5.6343600E-02    
 10     10.1200000             -1.2735800E-02    
 11      4.2830000             -1.9649500E-01    
 12      1.8050000             -3.5355500E-01    
 13      0.2782000              7.0091200E-01    
S   1
  1      0.6158000              1.0000000        
S   1
  1      0.1055000              1.0000000        
S   1
  1      0.0409000              1.0000000        
S   1
  1     10.9780000              1.0000000        
S   1
  1      2.0060000              1.0000000        
P   7
  1    504.9000000              2.3372800E-03    
  2    119.4000000              1.8541000E-02    
  3     37.9600000              8.4969300E-02    
  4     13.9500000              2.4461500E-01    
  5      5.4570000              4.2276600E-01    
  6      2.1770000              3.6843900E-01    
  7      0.2877000             -3.7900500E-03    
P   7
  1    504.9000000             -5.5523600E-04    
  2    119.4000000             -4.4591300E-03    
  3     37.9600000             -2.0635000E-02    
  4     13.9500000             -6.1769400E-02    
  5      5.4570000             -1.0892400E-01    
  6      2.1770000             -1.0559900E-01    
  7      0.2877000              5.7698100E-01    
P   1
  1      0.8010000              1.0000000        
P   1
  1      0.0971400              1.0000000        
P   1
  1      0.0307000              1.0000000        
P   1
  1      7.0840000              1.0000000        
P   1
  1      2.7010000              1.0000000        
D   1
  1      2.7500000              1.0000000        
D   1
  1      0.6480000              1.0000000        
D   1
  1      0.2180000              1.0000000        
D   1
  1      0.0775000              1.0000000        
D   1
  1     20.4790000              1.0000000        
D   1
  1      7.5040000              1.0000000        
F   1
  1      0.4520000              1.0000000        
F   1
  1      0.1650000              1.0000000        
F   1
  1      8.4620000              1.0000000        


name: aug-cc-pCV(T+d)Z
description: Core-valence basis sets for second-row atoms (Al-Ar)
elt: S
data:
SULFUR
S   13
  1 374100.0000000              5.4214000E-05    
  2  56050.0000000              4.2085500E-04    
  3  12760.0000000              2.2069800E-03    
  4   3615.0000000              9.1925800E-03    
  5   1183.0000000              3.2112300E-02    
  6    428.8000000              9.4668300E-02    
  7    167.8000000              2.2363000E-01    
  8     69.4700000              3.7439300E-01    
  9     29.8400000              3.2910800E-01    
 10     12.7200000              8.4703800E-02    
 11      5.2440000              4.4085100E-04    
 12      2.2190000              1.6482700E-03    
 13      0.3490000              3.0130600E-04    
S   13
  1 374100.0000000             -1.4983700E-05    
  2  56050.0000000             -1.1619800E-04    
  3  12760.0000000             -6.1158300E-04    
  4   3615.0000000             -2.5537000E-03    
  5   1183.0000000             -9.0870800E-03    
  6    428.8000000             -2.7704500E-02    
  7    167.8000000             -7.2002000E-02    
  8     69.4700000             -1.4643900E-01    
  9     29.8400000             -1.9515000E-01    
 10     12.7200000              8.1919300E-03    
 11      5.2440000              5.1660100E-01    
 12      2.2190000              5.4217800E-01    
 13      0.3490000             -9.1807200E-03    
S   13
  1 374100.0000000              4.3506600E-06    
  2  56050.0000000              3.3714000E-05    
  3  12760.0000000              1.7767400E-04    
  4   3615.0000000              7.4111600E-04    
  5   1183.0000000              2.6459100E-03    
  6    428.8000000              8.0748700E-03    
  7    167.8000000              2.1227600E-02    
  8     69.4700000              4.3832300E-02    
  9     29.8400000              6.1271600E-02    
 10     12.7200000             -3.6151000E-03    
 11      5.2440000             -2.0451000E-01    
 12      2.2190000             -3.8187100E-01    
 13      0.3490000              7.1414700E-01    
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
S   1
  1      0.0497000              1.0000000        
S   1
  1     12.9280000              1.0000000        
S   1
  1      2.4130000              1.0000000        
P   7
  1    574.4000000              2.4226400E-03    
  2    135.8000000              1.9279600E-02    
  3     43.1900000              8.8540100E-02    
  4     15.8700000              2.5465400E-01    
  5      6.2080000              4.3398400E-01    
  6      2.4830000              3.5495300E-01    
  7      0.3229000             -5.0297700E-03    
P   7
  1    574.4000000             -6.2010200E-04    
  2    135.8000000             -4.9388200E-03    
  3     43.1900000             -2.3264700E-02    
  4     15.8700000             -6.8519500E-02    
  5      6.2080000             -1.2389600E-01    
  6      2.4830000             -9.6949900E-02    
  7      0.3229000              5.6939400E-01    
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
P   1
  1      0.0351000              1.0000000        
P   1
  1      8.1140000              1.0000000        
P   1
  1      3.1060000              1.0000000        
D   1
  1      3.2390000              1.0000000        
D   1
  1      0.8120000              1.0000000        
D   1
  1      0.2730000              1.0000000        
D   1
  1      0.1010000              1.0000000        
D   1
  1     24.0050000              1.0000000        
D   1
  1      8.8180000              1.0000000        
F   1
  1      0.5570000              1.0000000        
F   1
  1      0.2180000              1.0000000        
F   1
  1     10.0520000              1.0000000        


name: aug-cc-pCV(T+d)Z
description: Core-valence basis sets for second-row atoms (Al-Ar)
elt: Cl
data:
CHLORINE
S   13
  1 456100.0000000              4.9297000E-05    
  2  68330.0000000              3.8302900E-04    
  3  15550.0000000              2.0085400E-03    
  4   4405.0000000              8.3855800E-03    
  5   1439.0000000              2.9470300E-02    
  6    520.4000000              8.7832500E-02    
  7    203.1000000              2.1147300E-01    
  8     83.9600000              3.6536400E-01    
  9     36.2000000              3.4088400E-01    
 10     15.8300000              1.0213300E-01    
 11      6.3340000              3.1167500E-03    
 12      2.6940000              1.0575100E-03    
 13      0.4313000              1.5613600E-04    
S   13
  1 456100.0000000             -1.3830400E-05    
  2  68330.0000000             -1.0727900E-04    
  3  15550.0000000             -5.6508300E-04    
  4   4405.0000000             -2.3613500E-03    
  5   1439.0000000             -8.4588600E-03    
  6    520.4000000             -2.5963800E-02    
  7    203.1000000             -6.8636200E-02    
  8     83.9600000             -1.4187400E-01    
  9     36.2000000             -1.9931900E-01    
 10     15.8300000             -1.9566200E-02    
 11      6.3340000              4.9974100E-01    
 12      2.6940000              5.6373600E-01    
 13      0.4313000             -8.3509100E-03    
S   13
  1 456100.0000000              4.1854600E-06    
  2  68330.0000000              3.2439500E-05    
  3  15550.0000000              1.7110500E-04    
  4   4405.0000000              7.1417600E-04    
  5   1439.0000000              2.5670500E-03    
  6    520.4000000              7.8855200E-03    
  7    203.1000000              2.1086700E-02    
  8     83.9600000              4.4226400E-02    
  9     36.2000000              6.5167000E-02    
 10     15.8300000              6.0301200E-03    
 11      6.3340000             -2.0649500E-01    
 12      2.6940000             -4.0587100E-01    
 13      0.4313000              7.2566100E-01    
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
S   1
  1      0.0591000              1.0000000        
S   1
  1     15.0640000              1.0000000        
S   1
  1      2.8740000              1.0000000        
P   7
  1    663.3000000              2.4044800E-03    
  2    156.8000000              1.9214800E-02    
  3     49.9800000              8.8509700E-02    
  4     18.4200000              2.5602000E-01    
  5      7.2400000              4.3692700E-01    
  6      2.9220000              3.5033400E-01    
  7      0.3818000             -4.5842300E-03    
P   7
  1    663.3000000             -6.5214500E-04    
  2    156.8000000             -5.1944500E-03    
  3     49.9800000             -2.4693800E-02    
  4     18.4200000             -7.2816700E-02    
  5      7.2400000             -1.3403000E-01    
  6      2.9220000             -9.4774200E-02    
  7      0.3818000              5.6466700E-01    
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
P   1
  1      0.0419000              1.0000000        
P   1
  1      9.4800000              1.0000000        
P   1
  1      3.6680000              1.0000000        
D   1
  1      3.8460000              1.0000000        
D   1
  1      1.0110000              1.0000000        
D   1
  1      0.3390000              1.0000000        
D   1
  1      0.1300000              1.0000000        
D   1
  1     28.0950000              1.0000000        
D   1
  1     10.3950000              1.0000000        
F   1
  1      0.7060000              1.0000000        
F   1
  1      0.3120000              1.0000000        
F   1
  1     11.7790000              1.0000000        


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: Al
data:
ALUMINUM
S   11
  1 3269000.0000000             0.0000021        
  2 489400.0000000              0.0000166        
  3 111400.0000000              0.0000875        
  4  31560.0000000              0.0003690        
  5  10320.0000000              0.0013390        
  6   3731.0000000              0.0043564        
  7   1456.0000000              0.0128955        
  8    604.1000000              0.0348201        
  9    263.5000000              0.0843530        
 10    119.8000000              0.1759070        
 11     56.3200000              0.2920910        
S   11
  1 3269000.0000000            -0.0000006        
  2 489400.0000000             -0.0000043        
  3 111400.0000000             -0.0000227        
  4  31560.0000000             -0.0000960        
  5  10320.0000000             -0.0003484        
  6   3731.0000000             -0.0011384        
  7   1456.0000000             -0.0033874        
  8    604.1000000             -0.0093151        
  9    263.5000000             -0.0233023        
 10    119.8000000             -0.0523486        
 11     56.3200000             -0.0999499        
S   1
  1     27.1900000              1.0000000        
S   1
  1     13.2600000              1.0000000        
S   1
  1      6.0520000              1.0000000        
S   1
  1      2.9810000              1.0000000        
S   1
  1      1.4760000              1.0000000        
S   1
  1      0.7334000              1.0000000        
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1088000              1.0000000        
S   1
  1      0.0467200              1.0000000        
S   1
  1      0.0177000              1.0000000        
P   3
  1   1461.0000000              0.0002086        
  2    346.2000000              0.0018101        
  3    112.2000000              0.0097343        
P   1
  1     42.5100000              1.0000000        
P   1
  1     17.7200000              1.0000000        
P   1
  1      7.8520000              1.0000000        
P   1
  1      3.5710000              1.0000000        
P   1
  1      1.6370000              1.0000000        
P   1
  1      0.7382000              1.0000000        
P   1
  1      0.2577000              1.0000000        
P   1
  1      0.0977300              1.0000000        
P   1
  1      0.0369000              1.0000000        
P   1
  1      0.0115000              1.0000000        
D   1
  1      1.3170000              1.0000000        
D   1
  1      0.5260000              1.0000000        
D   1
  1      0.2100000              1.0000000        
D   1
  1      0.0840000              1.0000000        
D   1
  1     30.2400000              1.0000000        
D   1
  1     14.2490000              1.0000000        
D   1
  1      6.7142000              1.0000000        
D   1
  1      3.1630000              1.0000000        
D   1
  1      0.0294000              1.0000000        
F   1
  1      0.1300000              1.0000000        
F   1
  1      0.2580000              1.0000000        
F   1
  1      0.5130000              1.0000000        
F   1
  1     15.6410000              1.0000000        
F   1
  1      6.5270000              1.0000000        
F   1
  1      2.7240000              1.0000000        
F   1
  1      0.0509000              1.0000000        
G   1
  1      0.2520000              1.0000000        
G   1
  1      0.5430000              1.0000000        
G   1
  1     11.8300000              1.0000000        
G   1
  1      4.5020000              1.0000000        
G   1
  1      0.1069000              1.0000000        
H   1
  1      0.4460000              1.0000000        
H   1
  1      8.5080000              1.0000000        
H   1
  1      0.2270000              1.0000000        


name: aug-cc-pCV5Z
description: contractions incorrect for Al-Ar aug-cc-pCV5Z
elt: Si
data:
SILICON
S   11
  1 3948000.0000000             0.0000020        
  2 591100.0000000              0.0000158        
  3 134500.0000000              0.0000834        
  4  38120.0000000              0.0003514        
  5  12460.0000000              0.0012766        
  6   4504.0000000              0.0041519        
  7   1758.0000000              0.0123030        
  8    729.1000000              0.0333102        
  9    318.0000000              0.0809845        
 10    144.6000000              0.1702900        
 11     67.9700000              0.2868790        
S   11
  1 3948000.0000000            -0.0000005        
  2 591100.0000000             -0.0000042        
  3 134500.0000000             -0.0000222        
  4  38120.0000000             -0.0000936        
  5  12460.0000000             -0.0003401        
  6   4504.0000000             -0.0011106        
  7   1758.0000000             -0.0033088        
  8    729.1000000             -0.0091160        
  9    318.0000000             -0.0228790        
 10    144.6000000             -0.0517119        
 11     67.9700000             -0.0999091        
S   1
  1     32.8200000              1.0000000        
S   1
  1     16.0300000              1.0000000        
S   1
  1      7.3960000              1.0000000        
S   1
  1      3.6610000              1.0000000        
S   1
  1      1.8230000              1.0000000        
S   1
  1      0.9147000              1.0000000        
S   1
  1      0.3393000              1.0000000        
S   1
  1      0.1500000              1.0000000        
S   1
  1      0.0643800              1.0000000        
S   1
  1      0.0260000              1.0000000        
P   3
  1   1780.0000000              0.0002012        
  2    421.8000000              0.0017494        
  3    136.7000000              0.0094814        
P   1
  1     51.8100000              1.0000000        
P   1
  1     21.6000000              1.0000000        
P   1
  1      9.5630000              1.0000000        
P   1
  1      4.3500000              1.0000000        
P   1
  1      2.0060000              1.0000000        
P   1
  1      0.9205000              1.0000000        
P   1
  1      0.3500000              1.0000000        
P   1
  1      0.1381000              1.0000000        
P   1
  1      0.0533800              1.0000000        
P   1
  1      0.0192000              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.3210000              1.0000000        
D   1
  1      0.8170000              1.0000000        
D   1
  1      2.0820000              1.0000000        
D   1
  1     39.9340000              1.0000000        
D   1
  1     19.4830000              1.0000000        
D   1
  1      9.5050000              1.0000000        
D   1
  1      4.6380000              1.0000000        
D   1
  1      0.0468000              1.0000000        
F   1
  1      0.1690000              1.0000000        
F   1
  1      0.3410000              1.0000000        
F   1
  1      0.6880000              1.0000000        
F   1
  1     18.9640000              1.0000000        
F   1
  1      7.9560000              1.0000000        
F   1
  1      3.3380000              1.0000000        
F   1
  1      0.0735000              1.0000000        
G   1
  1      0.3200000              1.0000000        
G   1
  1      0.7050000              1.0000000        
G   1
  1     14.5040000              1.0000000        
G   1
  1      5.5810000              1.0000000        
G   1
  1      0.1510000              1.0000000        
H   1
  1      0.5830000              1.0000000        
H   1
  1     10.5360000              1.0000000        
H   1
  1      0.3230000              1.0000000        


