# all_value

name: Def2-QZVP
description: N/A
elt: K
data:
POTASSIUM
S   11
  1 2022075.1391000             0.10144874011E-04      
  2 303044.6556800              0.78783500963E-04      
  3  69013.9384900              0.41380919674E-03      
  4  19559.2446150              0.17427571893E-02      
  5   6383.8934901              0.63004086126E-02      
  6   2305.3502858              0.20125347032E-01      
  7    899.14418101             0.56966060520E-01      
  8    372.59500133             0.13882654093    
  9    161.97635247             0.27132285414    
 10     73.085553853            0.36383620662    
 11     33.595644762            0.24724464776    
S   4
  1    685.49855365             0.44367463797E-02      
  2    211.66163373             0.42502718169E-01      
  3     80.851405131            0.18467742018    
  4     35.108667236            0.29353173891    
S   1
  1     14.409437283            1.0000000        
S   1
  1      6.8697147262           1.0000000        
S   1
  1      3.2121883687           1.0000000        
S   1
  1      1.2610484365           1.0000000        
S   1
  1      0.61438946301          1.0000000        
S   1
  1      0.27264370973          1.0000000        
S   1
  1      0.77173005207E-01            1.0000000        
S   1
  1      0.40918397569E-01            1.0000000        
S   1
  1      0.17055762425E-01            1.0000000        
P   9
  1   3469.6649718              0.21340225970E-03      
  2    822.02356107             0.18637844836E-02      
  3    266.58406636             0.10211431546E-01      
  4    101.28048161             0.40799604728E-01      
  5     42.429490761            0.12257473393    
  6     18.912083912            0.26405833679    
  7      8.7017779030           0.38227164575    
  8      4.0854567599           0.29998812383    
  9      1.8667286060           0.78007265591E-01      
P   5
  1     27.544639057           -0.58222994163E-02      
  2      9.2098893609          -0.26787531329E-01      
  3      1.7232877425           0.30666847665    
  4      0.77969303735          0.66927944165    
  5      0.34379047862          0.60376468615    
P   1
  1      0.14346681918          1.0000000        
P   1
  1      0.68000000000E-01            1.0000000        
P   1
  1      0.32000000000E-01            1.0000000        
P   1
  1      0.15300000000E-01            1.0000000        
D   1
  1      1.7000000              1.0000000        
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1800000              1.0000000        
D   1
  1      0.0540000              1.0000000        
F   1
  1      0.2670000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ca
data:
CALCIUM
S   11
  1 2433075.4304000             0.91625196182E-05      
  2 364160.4301500              0.71271617974E-04      
  3  82898.7476370              0.37433706369E-03      
  4  23499.7305400              0.15762862250E-02      
  5   7671.2245985              0.57026102580E-02      
  6   2770.2330687              0.18255738108E-01      
  7   1080.6807550              0.51906421035E-01      
  8    448.04894531             0.12791238579    
  9    194.92007727             0.25586635231    
 10     88.039793338            0.36028678275    
 11     40.645696719            0.26838462020    
S   4
  1    779.53331918            -0.18403005509E-01      
  2    241.18856300            -0.17649440544    
  3     92.403869324           -0.77662799584    
  4     39.786090342           -1.3352155444     
S   1
  1     18.195864278            1.0000000        
S   1
  1      8.3321457067           1.0000000        
S   1
  1      3.9190196209           1.0000000        
S   1
  1      1.6667099493           1.0000000        
S   1
  1      0.80891084908          1.0000000        
S   1
  1      0.36174199934          1.0000000        
S   1
  1      0.82379874526E-01            1.0000000        
S   1
  1      0.47947864375E-01            1.0000000        
S   1
  1      0.22308112408E-01            1.0000000        
P   9
  1   4064.2232796              0.19780891021E-03      
  2    962.91550624             0.17307465902E-02      
  3    312.34501046             0.95298721105E-02      
  4    118.76056036             0.38387459783E-01      
  5     49.816153133            0.11679256218    
  6     22.259679401            0.25637225097    
  7     10.286094124            0.37986193747    
  8      4.8606982416           0.30805760637    
  9      2.2525682942           0.85755999942E-01      
P   5
  1     31.467555443           -0.42441487483E-02      
  2     10.657589056           -0.19579425947E-01      
  3      2.0505555426           0.21237507422    
  4      0.94362089228          0.46277871121    
  5      0.42709067504          0.39177495728    
P   1
  1      0.17788187209          1.0000000        
P   1
  1      0.86000000000E-01            1.0000000        
P   1
  1      0.41500000000E-01            1.0000000        
P   1
  1      0.20000000000E-01            1.0000000        
D   3
  1     16.924012098            0.35543971560E-01      
  2      4.4655403330           0.18133698335    
  3      1.4347576200           0.48002060116    
D   1
  1      0.46552376784          1.0000000        
D   1
  1      0.14097711082          1.0000000        
D   1
  1      0.41467009281E-01            1.0000000        
F   1
  1      0.3210000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Sc
data:
SCANDIUM
S   11
  1 2855231.1264000             0.84862794535E-05      
  2 427433.3422100              0.65998092974E-04      
  3  97233.2185450              0.34740968058E-03      
  4  27496.2228460              0.14694099525E-02      
  5   8948.7324409              0.53410667286E-02      
  6   3221.0397292              0.17200652511E-01      
  7   1252.0534077              0.49287065332E-01      
  8    517.26093376             0.12273534550    
  9    224.33127242             0.24910183844    
 10    101.10551671             0.35884366997    
 11     46.684957855            0.27782811319    
S   4
  1    947.75965484             0.36123019249E-02      
  2    293.07262846             0.35616224567E-01      
  3    111.70230657             0.16664064248    
  4     47.756215212            0.32531051399    
S   1
  1     21.121984009            1.0000000        
S   1
  1      9.7765922198           1.0000000        
S   1
  1      4.5982699340           1.0000000        
S   1
  1      1.9928487767           1.0000000        
S   1
  1      0.95939954457          1.0000000        
S   1
  1      0.42566790070          1.0000000        
S   1
  1      0.98132196006E-01            1.0000000        
S   1
  1      0.56894222237E-01            1.0000000        
S   1
  1      0.25369907195E-01            1.0000000        
P   9
  1   4611.4680242              0.19180655992E-03      
  2   1092.4666458              0.16801897753E-02      
  3    354.41923265             0.92763338425E-02      
  4    134.83390286             0.37537202735E-01      
  5     56.610873926            0.11493045217    
  6     25.336605518            0.25446811084    
  7     11.741313238            0.37993352765    
  8      5.5697268625           0.30948776388    
  9      2.5949954062           0.86972259257E-01      
P   5
  1     35.951198081           -0.55780446917E-02      
  2     12.301020232           -0.25933825208E-01      
  3      2.3876557755           0.27489094204    
  4      1.1031823600           0.59208047142    
  5      0.50008479496          0.49113471853    
P   1
  1      0.20796508799          1.0000000        
P   1
  1      0.10100000000          1.0000000        
P   1
  1      0.48000000000E-01            1.0000000        
P   1
  1      0.23000000000E-01            1.0000000        
D   5
  1     73.531179748            0.22506354976E-02      
  2     21.764759639            0.16377610133E-01      
  3      7.9233701690           0.63330446952E-01      
  4      3.1847889778           0.17056208548    
  5      1.3427790019           0.30119020299    
D   1
  1      0.56149574983          1.0000000        
D   1
  1      0.22764073650          1.0000000        
D   1
  1      0.85211221793E-01            1.0000000        
D   1
  1      0.35E-01               1.0000000        
F   1
  1      1.4810000              1.0000000        
F   1
  1      0.3450000              1.0000000        
F   1
  1      0.1100000              1.0000000        
G   1
  1      0.2470000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ti
data:
TITANIUM
S   11
  1 3070548.8651000             0.86954016630E-05      
  2 460777.8864300              0.67452737727E-04      
  3 104901.2288900              0.35477293028E-03      
  4  29695.8611990              0.14977525588E-02      
  5   9678.8892688              0.54309912055E-02      
  6   3490.1877912              0.17439360524E-01      
  7   1359.2217621              0.49835634640E-01      
  8    562.42721208             0.12379633943    
  9    244.22296250             0.25057490943    
 10    110.16668710             0.35934609007    
 11     50.881903357            0.27594242664    
S   4
  1    965.95430789             0.41773927781E-02      
  2    299.27072059             0.40277148567E-01      
  3    114.83772939             0.17898686817    
  4     49.477578954            0.31783043543    
S   1
  1     22.982839977            1.0000000        
S   1
  1     10.518305037            1.0000000        
S   1
  1      4.9774390567           1.0000000        
S   1
  1      2.1339846838           1.0000000        
S   1
  1      1.0342457284           1.0000000        
S   1
  1      0.46199774995          1.0000000        
S   1
  1      0.10621264194          1.0000000        
S   1
  1      0.54340347374E-01            1.0000000        
S   1
  1      0.25110217385E-01            1.0000000        
P   9
  1   5169.6755427              0.18802523596E-03      
  2   1225.0961638              0.16473458826E-02      
  3    397.60051934             0.91104554321E-02      
  4    151.36154684             0.36987450926E-01      
  5     63.613321773            0.11376329624    
  6     28.514560307            0.25345208574    
  7     13.248003298            0.38019402704    
  8      6.3048807760           0.30989136346    
  9      2.9493525821           0.87418944007E-01      
P   5
  1     40.738772213           -0.73233793267E-02      
  2     14.062358461           -0.34282591082E-01      
  3      2.7460680961           0.35655009250    
  4      1.2713688141           0.76112035427    
  5      0.57610015545          0.62716743237    
P   1
  1      0.23981820724          1.0000000        
P   1
  1      0.11000000000          1.0000000        
P   1
  1      0.50000000000E-01            1.0000000        
P   1
  1      0.23000000000E-01            1.0000000        
D   5
  1     89.589880075            0.21223030030E-02      
  2     26.591412960            0.15911819913E-01      
  3      9.7739715702           0.62875243121E-01      
  4      3.9625083655           0.17144170807    
  5      1.6890532654           0.30565506624    
D   1
  1      0.71539771469          1.0000000        
D   1
  1      0.29366677748          1.0000000        
D   1
  1      0.11079094851          1.0000000        
D   1
  1      0.45E-01               1.0000000        
F   1
  1      2.0930000              1.0000000        
F   1
  1      0.5620000              1.0000000        
F   1
  1      0.1910000              1.0000000        
G   1
  1      0.6340000              1.0000000        


name: Def2-QZVP
description: N/A
elt: V
data:
VANADIUM
S   11
  1 3360380.0382000             0.87027840678E-05      
  2 502646.7317800              0.67786024965E-04      
  3 114247.2286700              0.35699229090E-03      
  4  32321.9726300              0.15075507352E-02      
  5  10532.9472710              0.54664377528E-02      
  6   3798.3004439              0.17547310839E-01      
  7   1479.6094715              0.50106594778E-01      
  8    612.57405507             0.12431296066    
  9    266.22103326             0.25117026883    
 10    120.21980126             0.35926015903    
 11     55.591180848            0.27505075685    
S   4
  1   1082.4768635              0.39326847695E-02      
  2    334.94462061             0.38298477998E-01      
  3    128.31559026             0.17259908827    
  4     55.311589616            0.31287423870    
S   1
  1     25.108383036            1.0000000        
S   1
  1     11.667553242            1.0000000        
S   1
  1      5.5372073270           1.0000000        
S   1
  1      2.3781007618           1.0000000        
S   1
  1      1.1506947329           1.0000000        
S   1
  1      0.51283991040          1.0000000        
S   1
  1      0.11625711449          1.0000000        
S   1
  1      0.58272785598E-01            1.0000000        
S   1
  1      0.26662312245E-01            1.0000000        
P   9
  1   5782.8035005              0.18344743045E-03      
  2   1369.9392282              0.16095217453E-02      
  3    444.53147129             0.89242268749E-02      
  4    169.25617556             0.36375182379E-01      
  5     71.168730031            0.11246803294    
  6     31.933358374            0.25226107794    
  7     14.865336779            0.38039695005    
  8      7.0921740091           0.31068797325    
  9      3.3281157846           0.88141200458E-01      
P   5
  1     45.842906017           -0.56661391945E-02      
  2     15.940339016           -0.26718979445E-01      
  3      3.1257155025           0.27354632707    
  4      1.4485867558           0.57972883053    
  5      0.65577902825          0.47601110515    
P   1
  1      0.27311626644          1.0000000        
P   1
  1      0.12200000000          1.0000000        
P   1
  1      0.55000000000E-01            1.0000000        
P   1
  1      0.25000000000E-01            1.0000000        
D   5
  1    103.95047414             0.21007158819E-02      
  2     30.901688665            0.16015244877E-01      
  3     11.420321145            0.64127456940E-01      
  4      4.6573272292           0.17488905695    
  5      1.9963682623           0.31003778048    
D   1
  1      0.84967249531          1.0000000        
D   1
  1      0.34953221876          1.0000000        
D   1
  1      0.13165588233          1.0000000        
D   1
  1      0.52E-01               1.0000000        
F   1
  1      2.9330000              1.0000000        
F   1
  1      0.8310000              1.0000000        
F   1
  1      0.2570000              1.0000000        
G   1
  1      1.0090000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Cr
data:
CHROMIUM
S   11
  1 3637838.6820000             0.87693297699E-05      
  2 544864.4610000              0.68169050223E-04      
  3 123997.5507900              0.35844590272E-03      
  4  35116.7331660              0.15117006948E-02      
  5  11455.7022980              0.54731929774E-02      
  6   4135.9906712              0.17539430107E-01      
  7   1613.2513581              0.50004870927E-01      
  8    668.77932380             0.12393518958    
  9    291.01365155             0.25039606407    
 10    131.57328167             0.35870470429    
 11     60.924567928            0.27581148880    
S   4
  1   1196.2899601              0.77368642037E-02      
  2    369.76947592             0.75837835399E-01      
  3    141.54426084             0.34435148637    
  4     60.999228765            0.63249297923    
S   1
  1     27.599113358            1.0000000        
S   1
  1     12.882112056            1.0000000        
S   1
  1      6.1247513721           1.0000000        
S   1
  1      2.6332895309           1.0000000        
S   1
  1      1.2708482289           1.0000000        
S   1
  1      0.56483575923          1.0000000        
S   1
  1      0.12596808943          1.0000000        
S   1
  1      0.62045607277E-01            1.0000000        
S   1
  1      0.28144312720E-01            1.0000000        
P   9
  1   6395.8781792              0.18104788151E-03      
  2   1515.1701574              0.15893658935E-02      
  3    491.70538681             0.88258739429E-02      
  4    187.28416675             0.36068946983E-01      
  5     78.800346444            0.11189649648    
  6     35.396291693            0.25202239843    
  7     16.509278879            0.38082266430    
  8      7.8947396863           0.31035222437    
  9      3.7136414465           0.87980310362E-01      
P   5
  1     51.259312534           -0.60542038165E-02      
  2     17.934932523           -0.28761764001E-01      
  3      3.5257174218           0.29087768170    
  4      1.6339163906           0.61267525056    
  5      0.73852413834          0.50126035018    
P   1
  1      0.30752368193          1.0000000        
P   1
  1      0.13500000000          1.0000000        
P   1
  1      0.59000000000E-01            1.0000000        
P   1
  1      0.26000000000E-01            1.0000000        
D   5
  1    118.24986288             0.21012757435E-02      
  2     35.193935700            0.16212269500E-01      
  3     13.057816022            0.65581852668E-01      
  4      5.3485602844           0.17849601449    
  5      2.3004233713           0.31376763016    
D   1
  1      0.98114328305          1.0000000        
D   1
  1      0.40334183206          1.0000000        
D   1
  1      0.15135589551          1.0000000        
D   1
  1      0.60E-01               1.0000000        
F   1
  1      3.7330000              1.0000000        
F   1
  1      1.1470000              1.0000000        
F   1
  1      0.3660000              1.0000000        
G   1
  1      1.3820000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Mn
data:
MANGANESE
S   11
  1 4289357.6441000             0.79360554972E-05      
  2 636361.0028500              0.62542986761E-04      
  3 143637.2756900              0.33226388724E-03      
  4  40406.3454320              0.14130009568E-02      
  5  13104.3634170              0.51560918319E-02      
  6   4705.0664255              0.16659574919E-01      
  7   1825.7125432              0.47908083403E-01      
  8    753.33816229             0.11994903752    
  9    326.47253285             0.24550296959    
 10    147.10300670             0.35822739571    
 11     67.987226869            0.28295764442    
S   4
  1   1300.7266717              0.76025154141E-02      
  2    402.72027544             0.74365109808E-01      
  3    154.38971348             0.33780474819    
  4     66.443384613            0.62779331746    
S   1
  1     30.975316006            1.0000000        
S   1
  1     14.222980890            1.0000000        
S   1
  1      6.7598265074           1.0000000        
S   1
  1      2.9087083287           1.0000000        
S   1
  1      1.3966507792           1.0000000        
S   1
  1      0.61792624091          1.0000000        
S   1
  1      0.13439483715          1.0000000        
S   1
  1      0.65195053803E-01            1.0000000        
S   1
  1      0.29415713624E-01            1.0000000        
P   9
  1   6483.2629658              0.20479778890E-03      
  2   1556.7134859              0.17525750185E-02      
  3    509.73925460             0.95798802458E-02      
  4    195.28408089             0.38681362983E-01      
  5     82.542547525            0.11832401588    
  6     37.212076731            0.26168459627    
  7     17.425804462            0.38400628821    
  8      8.3691376962           0.29704166759    
  9      3.9409000444           0.78263290323E-01      
P   5
  1     57.202741010           -0.47749099800E-02      
  2     20.090935947           -0.22989729915E-01      
  3      3.9357553763           0.23197065881    
  4      1.8181984012           0.48435204043    
  5      0.81881535281          0.39159479004    
P   1
  1      0.34038359193          1.0000000        
P   1
  1      0.15000000000          1.0000000        
P   1
  1      0.63000000000E-01            1.0000000        
P   1
  1      0.27000000000E-01            1.0000000        
D   6
  1    200.40254535             0.89549560240E-03      
  2     59.898225773            0.76257630942E-02      
  3     22.810570167            0.34523224226E-01      
  4      9.5874142097           0.10552676975    
  5      4.2933710910           0.22575377683    
  6      1.9537618373           0.32766533667    
D   1
  1      0.87378873598          1.0000000        
D   1
  1      0.37597748904          1.0000000        
D   1
  1      0.14811547592          1.0000000        
D   1
  1      0.60E-01               1.0000000        
F   1
  1      4.3530000              1.0000000        
F   1
  1      1.3260000              1.0000000        
F   1
  1      0.4080000              1.0000000        
G   1
  1      1.7550000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Fe
data:
IRON
S   11
  1 4313154.4338000             0.86712290122E-05      
  2 645875.0825300              0.67423150519E-04      
  3 146981.8769800              0.35448747955E-03      
  4  41630.6150440              0.14948285557E-02      
  5  13580.6201090              0.54136698440E-02      
  6   4902.0620613              0.17362460824E-01      
  7   1911.2900837              0.49566574059E-01      
  8    791.99837852             0.12309089705    
  9    344.54799181             0.24936705764    
 10    155.78722730             0.35858414677    
 11     72.179380315            0.27738221642    
S   4
  1   1417.9125091              0.74871631942E-02      
  2    439.23184195             0.73337584435E-01      
  3    168.51006820             0.33383143870    
  4     72.776269412            0.62022524641    
S   1
  1     32.752961774            1.0000000        
S   1
  1     15.434336101            1.0000000        
S   1
  1      7.3639318205           1.0000000        
S   1
  1      3.1698832880           1.0000000        
S   1
  1      1.5243708395           1.0000000        
S   1
  1      0.67496281152          1.0000000        
S   1
  1      0.14718566032          1.0000000        
S   1
  1      0.70082216629E-01            1.0000000        
S   1
  1      0.31208269419E-01            1.0000000        
P   9
  1   7709.0587627              0.17711229843E-03      
  2   1826.4666323              0.15560056795E-02      
  3    592.84368362             0.86629536960E-02      
  4    225.93763245             0.35565954156E-01      
  5     95.164758890            0.11098847278    
  6     42.823132375            0.25177796624    
  7     20.036286581            0.38166911079    
  8      9.6159346283           0.30963598261    
  9      4.5393538787           0.87558276626E-01      
P   5
  1     62.997519003           -0.50910388724E-02      
  2     22.262748731           -0.24540463235E-01      
  3      4.3900064942           0.24345605487    
  4      2.0328913928           0.50781898425    
  5      0.91592621576          0.41214895672    
P   1
  1      0.38036653507          1.0000000        
P   1
  1      0.1600000              1.0000000        
P   1
  1      0.0670000              1.0000000        
P   1
  1      0.0280000              1.0000000        
D   6
  1    218.33430163             0.93700006628E-03      
  2     65.256292616            0.80008769378E-02      
  3     24.866944817            0.36305286587E-01      
  4     10.473399301            0.11057189871    
  5      4.6947005007           0.23219588596    
  6      2.1315982534           0.32922859685    
D   1
  1      0.94748004605          1.0000000        
D   1
  1      0.40346488831          1.0000000        
D   1
  1      0.15687414728          1.0000000        
D   1
  1      0.62E-01               1.0000000        
F   1
  1      5.1030000              1.0000000        
F   1
  1      1.5980000              1.0000000        
F   1
  1      0.5050000              1.0000000        
G   1
  1      2.1280000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Co
data:
COBALT
S   11
  1 4658206.5032000             0.86609506454E-05      
  2 697560.8745300              0.67336300186E-04      
  3 158759.8712400              0.35399044899E-03      
  4  44969.0993790              0.14926384309E-02      
  5  14670.7142470              0.54053095095E-02      
  6   5295.8947250              0.17335233605E-01      
  7   2065.0581167              0.49486641301E-01      
  8    855.90627750             0.12289351961    
  9    372.48747255             0.24903230028    
 10    168.50576608             0.35838320259    
 11     78.128761566            0.27777974150    
S   4
  1   1534.5149885              0.74464372833E-02      
  2    475.52976096             0.72993601986E-01      
  3    182.54836839             0.33243104986    
  4     78.916467177            0.61900490005    
S   1
  1     35.500865522            1.0000000        
S   1
  1     16.790414486            1.0000000        
S   1
  1      8.0240232510           1.0000000        
S   1
  1      3.4571682964           1.0000000        
S   1
  1      1.6599835391           1.0000000        
S   1
  1      0.73380022453          1.0000000        
S   1
  1      0.15878613103          1.0000000        
S   1
  1      0.74535659476E-01            1.0000000        
S   1
  1      0.32867351695E-01            1.0000000        
P   9
  1   8425.4331352              0.17491775490E-03      
  2   1995.8758452              0.15378901702E-02      
  3    647.76765681             0.85752453448E-02      
  4    246.88261214             0.35295266911E-01      
  5    104.00952246             0.11050007672    
  6     46.827478138            0.25160924538    
  7     21.934444535            0.38209003019    
  8     10.540499528            0.30947119879    
  9      4.9820419385           0.87436873012E-01      
P   5
  1     69.270787130           -0.61172424428E-02      
  2     24.583977935           -0.29655043898E-01      
  3      4.8562258878           0.29163333190    
  4      2.2480916102           0.60629408335    
  5      1.0114285977           0.49057440018    
P   1
  1      0.41919905455          1.0000000        
P   1
  1      0.1750000              1.0000000        
P   1
  1      0.0730000              1.0000000        
P   1
  1      0.0300000              1.0000000        
D   6
  1    237.58450966             0.97593282671E-03      
  2     71.086896302            0.83432571945E-02      
  3     27.119080683            0.37958471100E-01      
  4     11.448239054            0.11522936171    
  5      5.1391806672           0.23843467913    
  6      2.3323492099           0.33205699955    
D   1
  1      1.0338662062           1.0000000        
D   1
  1      0.43785146294          1.0000000        
D   1
  1      0.16895004948          1.0000000        
D   1
  1      0.66E-01               1.0000000        
F   1
  1      5.9750000              1.0000000        
F   1
  1      1.9030000              1.0000000        
F   1
  1      0.5940000              1.0000000        
G   1
  1      2.5000000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ni
data:
NICKEL
S   11
  1 5037649.9532000             0.86072778771E-05      
  2 754246.3941800              0.66935354750E-04      
  3 171644.1601000              0.35190801168E-03      
  4  48617.2302860              0.14839082715E-02      
  5  15860.9617950              0.53736344264E-02      
  6   5726.0018653              0.17233376287E-01      
  7   2232.9547317              0.49211476915E-01      
  8    925.49649101             0.12232504536    
  9    402.75336913             0.24829251588    
 10    182.19422856             0.35825476194    
 11     84.494109788            0.27881865553    
S   4
  1   1678.0564586              0.82462870895E-02      
  2    519.21358326             0.81505940361E-01      
  3    198.95881607             0.37495727651    
  4     85.901180703            0.70841743832    
S   1
  1     38.435760123            1.0000000        
S   1
  1     18.252349351            1.0000000        
S   1
  1      8.7283616939           1.0000000        
S   1
  1      3.7616245662           1.0000000        
S   1
  1      1.8028217338           1.0000000        
S   1
  1      0.79507140513          1.0000000        
S   1
  1      0.17031720284          1.0000000        
S   1
  1      0.78971236177E-01            1.0000000        
S   1
  1      0.34503486750E-01            1.0000000        
P   9
  1   9156.5701453              0.17346418360E-03      
  2   2169.0239526              0.15257220493E-02      
  3    703.98918991             0.85163281036E-02      
  4    268.36293215             0.35117466952E-01      
  5    113.10288796             0.11020275383    
  6     50.955539222            0.25162601670    
  7     23.896708209            0.38246389853    
  8     11.498241522            0.30907230267    
  9      5.4410908056           0.87194377415E-01      
P   5
  1     75.938560736           -0.74635546629E-02      
  2     27.037350184           -0.36453401627E-01      
  3      5.3404687432           0.35633549406    
  4      2.4700181361           0.73774121992    
  5      1.1095029064           0.59439383024    
P   1
  1      0.45899767101          1.0000000        
P   1
  1      0.1870000              1.0000000        
P   1
  1      0.0762000              1.0000000        
P   1
  1      0.0310000              1.0000000        
D   6
  1    258.11131142             0.23726274275E-02      
  2     77.254891371            0.20330132784E-01      
  3     29.500240033            0.92748486665E-01      
  4     12.477446945            0.28082284560    
  5      5.6070455111           0.57392657880    
  6      2.5427744163           0.78766058527    
D   1
  1      1.1238296774           1.0000000        
D   1
  1      0.47361171459          1.0000000        
D   1
  1      0.18161858319          1.0000000        
D   1
  1      0.71E-01               1.0000000        
F   1
  1      6.7580000              1.0000000        
F   1
  1      2.1740000              1.0000000        
F   1
  1      0.6810000              1.0000000        
G   1
  1      2.8720000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Cu
data:
COPPER
S   11
  1 5056467.8898000             0.93501916365E-05      
  2 759457.8383500              0.72323443222E-04      
  3 173524.8849700              0.37813833845E-03      
  4  49327.2599880              0.15870129862E-02      
  5  16144.1499300              0.57220685294E-02      
  6   5844.5964680              0.18268390048E-01      
  7   2284.6812739              0.51893720863E-01      
  8    948.88232514             0.12796192366    
  9    413.66215455             0.25629891036    
 10    187.38942059             0.36064416138    
 11     86.872771648            0.26833664660    
S   4
  1   1744.0598287              0.88587079141E-02      
  2    540.93295513             0.86522785813E-01      
  3    207.99736224             0.38932285258    
  4     90.475793036            0.69777199902    
S   1
  1     38.869687699            1.0000000        
S   1
  1     18.974829147            1.0000000        
S   1
  1      9.0953644635           1.0000000        
S   1
  1      3.8330020174           1.0000000        
S   1
  1      1.8198891499           1.0000000        
S   1
  1      0.79068098393          1.0000000        
S   1
  1      0.14914142106          1.0000000        
S   1
  1      0.72448090592E-01            1.0000000        
S   1
  1      0.30959925368E-01            1.0000000        
P   9
  1   9720.4614555              0.17828803512E-03      
  2   2302.7557452              0.15678108633E-02      
  3    747.48498314             0.87470094509E-02      
  4    285.00132623             0.36044549301E-01      
  5    120.15121609             0.11287209053    
  6     54.145261156            0.25647377341    
  7     25.406033563            0.38512918379    
  8     12.224331465            0.30316512356    
  9      5.7638720668           0.81677218969E-01      
P   5
  1     83.210837217           -0.63530359993E-02      
  2     29.694779129           -0.31383834666E-01      
  3      5.8248516206           0.30930039753    
  4      2.6746181180           0.63583925938    
  5      1.1841836775           0.50946045967    
P   1
  1      0.48043583535          1.0000000        
P   1
  1      0.1870000              1.0000000        
P   1
  1      0.0762000              1.0000000        
P   1
  1      0.0310000              1.0000000        
D   6
  1    249.54025080             0.12432881244E-02      
  2     74.683914534            0.10456901995E-01      
  3     28.392717116            0.46451241249E-01      
  4     11.955968430            0.13541359729    
  5      5.3210744624           0.25852899978    
  6      2.3661189459           0.33168127635    
D   1
  1      1.0131863994           1.0000000        
D   1
  1      0.40710035940          1.0000000        
D   1
  1      0.14742541032          1.0000000        
D   1
  1      0.71E-01               1.0000000        
F   1
  1      6.9620000              1.0000000        
F   1
  1      2.2330000              1.0000000        
F   1
  1      0.7040000              1.0000000        
G   1
  1      3.2450000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Zn
data:
ZINC
S   11
  1 5742307.1507000             0.86864381562E-05      
  2 861450.7879000              0.67364668570E-04      
  3 196346.0586600              0.35349715135E-03      
  4  55682.8707370              0.14884153943E-02      
  5  18183.9023940              0.53840916617E-02      
  6   6569.6448019              0.17252738209E-01      
  7   2563.5613276              0.49238679132E-01      
  8   1063.1147176              0.12235812174    
  9    462.89771078             0.24835390245    
 10    209.52821049             0.35830632832    
 11     97.240787991            0.27880259960    
S   4
  1   1929.2689992              0.83077002177E-02      
  2    598.07122307             0.81882590163E-01      
  3    229.69667336             0.37588060221    
  4     99.416819228            0.71067260445    
S   1
  1     44.241101421            1.0000000        
S   1
  1     21.194367113            1.0000000        
S   1
  1     10.158731597            1.0000000        
S   1
  1      4.3746176158           1.0000000        
S   1
  1      2.0901489071           1.0000000        
S   1
  1      0.91869136437          1.0000000        
S   1
  1      0.19278660606          1.0000000        
S   1
  1      0.87329915171E-01            1.0000000        
S   1
  1      0.37552217126E-01            1.0000000        
P   9
  1  10690.4451070              0.17142867222E-03      
  2   2532.3159340              0.15088012830E-02      
  3    821.94295003             0.84368777910E-02      
  4    313.42757800             0.34898103208E-01      
  5    132.18314247             0.10993617353    
  6     59.620554387            0.25207277070    
  7     28.019488868            0.38325657524    
  8     13.511704850            0.30787091255    
  9      6.4053711253           0.86411696761E-01      
P   5
  1     89.981131918           -0.96262847843E-02      
  2     32.241767106           -0.47509407258E-01      
  3      6.3809448581           0.45834100431    
  4      2.9477928353           0.94473799128    
  5      1.3200854955           0.75923464871    
P   1
  1      0.54424674445          1.0000000        
P   1
  1      0.25799971797          1.0000000        
P   1
  1      0.92863192359E-01            1.0000000        
P   1
  1      0.34059341410E-01            1.0000000        
D   6
  1    305.22298937             0.27359792434E-02      
  2     91.468273202            0.23585229776E-01      
  3     34.986985968            0.10858422440    
  4     14.849415187            0.32843594226    
  5      6.6858545707           0.66180235634    
  6      3.0309412620           0.89165339320    
D   1
  1      1.3355050671           1.0000000        
D   1
  1      0.55883176392          1.0000000        
D   1
  1      0.21180799287          1.0000000        
D   1
  1      0.83E-01               1.0000000        
F   1
  1      8.0200000              1.0000000        
F   1
  1      2.6140000              1.0000000        
F   1
  1      0.8360000              1.0000000        
G   1
  1      3.6170000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ga
data:
GALLIUM
S   11
  1 6623802.0274000             0.79091326051E-05      
  2 987904.0707500              0.61835727406E-04      
  3 224132.0589900              0.32636322451E-03      
  4  63315.1929430              0.13810365049E-02      
  5  20611.3127020              0.50153772104E-02      
  6   7429.1672482              0.16130936803E-01      
  7   2894.2071720              0.46240827188E-01      
  8   1198.9915786              0.11579099571    
  9    521.82003812             0.23834840794    
 10    236.27549237             0.35374255971    
 11    109.98395671             0.29055721918    
S   4
  1   2101.2587253              0.83039611523E-02      
  2    650.97022519             0.82254127688E-01      
  3    250.22438356             0.38021717478    
  4    108.17616625             0.74503594690    
S   1
  1     51.057486710            1.0000000        
S   1
  1     23.647474527            1.0000000        
S   1
  1     11.361701144            1.0000000        
S   1
  1      5.0178135897           1.0000000        
S   1
  1      2.4102674998           1.0000000        
S   1
  1      1.0741046685           1.0000000        
S   1
  1      0.25745075831          1.0000000        
S   1
  1      0.12175227548          1.0000000        
S   1
  1      0.52360599017E-01            1.0000000        
P   9
  1  14711.7504830              0.11130990649E-03      
  2   3482.1451716              0.98495921142E-03      
  3   1130.2186655              0.55854182058E-02      
  4    431.54093448             0.23682413047E-01      
  5    182.41723648             0.78211587173E-01      
  6     82.706753603            0.19503829929    
  7     39.228128772            0.34131988495    
  8     19.201979939            0.35718665135    
  9      9.5056966689           0.16395955052    
P   2
  1     92.615613022           -0.85848284169E-01      
  2     33.750148165           -0.39435019538    
P   4
  1      7.3482283015           0.37941606569    
  2      3.7813384844           0.71306291866    
  3      2.3145183128           0.43210001481    
  4      0.80346859715          0.25838122797    
P   1
  1      1.5423710087           1.0000000        
P   1
  1      0.32910239639          1.0000000        
P   1
  1      0.11834088831          1.0000000        
P   1
  1      0.41627877699E-01            1.0000000        
D   7
  1    363.49565218             0.87402299276E-03      
  2    109.01749589             0.76751934098E-02      
  3     41.866430715            0.36388975341E-01      
  4     17.879279894            0.11325183017    
  5      8.1201893671           0.23770881294    
  6      3.7360611356           0.33306060389    
  7      1.6826812549           0.33130613756    
D   1
  1      0.72655790500          1.0000000        
D   1
  1      0.28498585079          1.0000000        
D   1
  1      0.1120000              1.0000000        
F   1
  1      0.18100000000          1.0000000        
F   1
  1      0.47100000000          1.0000000        
G   1
  1      0.40320000000          1.0000000        


name: Def2-QZVP
description: N/A
elt: Ge
data:
GERMANIUM
S   11
  1 7233056.0346000             0.76638751457E-05      
  2 1082886.1731000             0.59603601369E-04      
  3 246481.4695900              0.31319088031E-03      
  4  69862.4269550              0.13194051561E-02      
  5  22815.8096620              0.47736099191E-02      
  6   8246.5369297              0.15319250467E-01      
  7   3219.9367257              0.43900870673E-01      
  8   1336.5743706              0.11028573632    
  9    582.87737501             0.22912630489    
 10    264.59511360             0.34779259246    
 11    123.77823320             0.29968722223    
S   4
  1   2311.1055804              0.75033084731E-02      
  2    716.27089868             0.74778386626E-01      
  3    275.45330910             0.35092882302    
  4    118.93292565             0.72055989686    
S   1
  1     58.435699085            1.0000000        
S   1
  1     26.261575973            1.0000000        
S   1
  1     12.664880671            1.0000000        
S   1
  1      5.7269548505           1.0000000        
S   1
  1      2.7555023203           1.0000000        
S   1
  1      1.2432886754           1.0000000        
S   1
  1      0.33107183846          1.0000000        
S   1
  1      0.15964081368          1.0000000        
S   1
  1      0.68463178923E-01            1.0000000        
P   9
  1  16555.7110740              0.10199370391E-03      
  2   3914.9903745              0.90504190546E-03      
  3   1269.4766518              0.51558490762E-02      
  4    484.35437789             0.22010335708E-01      
  5    204.64985822             0.73434798827E-01      
  6     92.791032094            0.18608955294    
  7     44.055060255            0.33330981945    
  8     21.601319931            0.36229776246    
  9     10.732169233            0.17765186263    
P   2
  1    100.88933962            -0.11146182144    
  2     36.640254741           -0.52324324314    
P   4
  1      8.0343224115           0.31484763263    
  2      4.5613438333           0.38737744790    
  3      3.1794882223           0.50034353638    
  4      0.92612041457          0.22656707948    
P   1
  1      1.7977040907           1.0000000        
P   1
  1      0.41386865432          1.0000000        
P   1
  1      0.15830798709          1.0000000        
P   1
  1      0.57877035911E-01            1.0000000        
D   7
  1    420.99565921             0.78212192196E-03      
  2    126.36209818             0.69560123831E-02      
  3     48.661473548            0.33712188323E-01      
  4     20.880325527            0.10717291194    
  5      9.5418229355           0.23161030141    
  6      4.4353653868           0.33390954301    
  7      2.0285421942           0.33720676378    
D   1
  1      0.89484935267          1.0000000        
D   1
  1      0.35786074334          1.0000000        
D   1
  1      0.1400000              1.0000000        
F   1
  1      0.54920000000          1.0000000        
F   1
  1      0.21900000000          1.0000000        
G   1
  1      0.46810000000          1.0000000        


name: Def2-QZVP
description: N/A
elt: As
data:
ARSENIC
S   11
  1 8217482.6198000             0.70590618422E-05      
  2 1230500.3720000             0.54880889611E-04      
  3 280225.8664800              0.28809164698E-03      
  4  79482.5094150              0.12129779464E-02      
  5  25963.7833510              0.43914559880E-02      
  6   9381.4010193              0.14125362961E-01      
  7   3660.4911972              0.40657915618E-01      
  8   1518.2356024              0.10300382633    
  9    661.80098920             0.21730077101    
 10    300.58642127             0.33995751412    
 11    141.11137296             0.31088634077    
S   4
  1   2577.0870580              0.70752991980E-02      
  2    798.07872277             0.71383615256E-01      
  3    306.57574948             0.34287024634    
  4    132.27558802             0.74361403413    
S   1
  1     67.448702235            1.0000000        
S   1
  1     29.209180441            1.0000000        
S   1
  1     14.156509326            1.0000000        
S   1
  1      6.5561506682           1.0000000        
S   1
  1      3.1392847238           1.0000000        
S   1
  1      1.4294631050           1.0000000        
S   1
  1      0.41103390885          1.0000000        
S   1
  1      0.20032453310          1.0000000        
S   1
  1      0.85669928850E-01            1.0000000        
P   10
  1  25198.5042780              0.54758168372E-04      
  2   5972.5601381              0.48572462452E-03      
  3   1941.9123183              0.27908085625E-02      
  4    743.59381104             0.12201505962E-01      
  5    315.63828052             0.42666285138E-01      
  6    143.96878925             0.11870919141    
  7     69.068683164            0.24909407023    
  8     34.254305629            0.36061356903    
  9     17.371746759            0.29392241832    
 10      8.7634555628           0.97829057366E-01      
P   5
  1    228.49024582            -0.24900140765E-02      
  2     86.313555488           -0.19482515843E-01      
  3     36.751366267           -0.61495071038E-01      
  4      8.5365149464           0.47258065062    
  5      4.1935128599           1.0236065079     
P   1
  1      2.0464980417           1.0000000        
P   1
  1      0.98000000000          1.0000000        
P   1
  1      0.40534340618          1.0000000        
P   1
  1      0.16655070471          1.0000000        
P   1
  1      0.65981706123E-01            1.0000000        
D   7
  1    479.32599612             0.71722800196E-03      
  2    143.96064855             0.64419223046E-02      
  3     55.548909224            0.31776498964E-01      
  4     23.927581006            0.10276249168    
  5     10.988194172            0.22710952843    
  6      5.1489356262           0.33477474118    
  7      2.3836810892           0.34175986071    
D   1
  1      1.0688204667           1.0000000        
D   1
  1      0.43305693742          1.0000000        
D   1
  1      0.1700000              1.0000000        
F   1
  1      0.26400000000          1.0000000        
F   1
  1      0.64400000000          1.0000000        
G   1
  1      0.54650000000          1.0000000        


name: Def2-QZVP
description: N/A
elt: Se
data:
SELENIUM
S   11
  1 9520446.7743000             0.63309690150E-05      
  2 1424984.0802000             0.49267697990E-04      
  3 324127.5768200              0.25920249744E-03      
  4  91774.8769500              0.10943145743E-02      
  5  29932.7257250              0.39706139067E-02      
  6  10804.6179050              0.12801187916E-01      
  7   4214.0134779              0.36980379417E-01      
  8   1747.8116633              0.94461349896E-01      
  9    762.12160878             0.20274705434    
 10    346.45604141             0.32878956424    
 11    163.11569304             0.32300252609    
S   4
  1   2614.5153067              0.79113928518E-02      
  2    818.68552756             0.77187739408E-01      
  3    318.63398991             0.35672061949    
  4    139.04844125             0.75846750004    
S   1
  1     78.348734788            1.0000000        
S   1
  1     31.704290663            1.0000000        
S   1
  1     15.505859269            1.0000000        
S   1
  1      7.3227423625           1.0000000        
S   1
  1      3.4969483549           1.0000000        
S   1
  1      1.6121546085           1.0000000        
S   1
  1      0.49587158541          1.0000000        
S   1
  1      0.24092138175          1.0000000        
S   1
  1      0.10231739397          1.0000000        
P   10
  1  25360.2156150              0.60531790911E-04      
  2   5993.7896610              0.53987774437E-03      
  3   1943.0741755              0.31130456170E-02      
  4    742.35316156             0.13599674694E-01      
  5    314.62114597             0.47298958377E-01      
  6    143.34748044             0.12981487726    
  7     68.673617552            0.26569982215    
  8     34.013554117            0.36723195311    
  9     17.198099621            0.27478356345    
 10      8.5830329629           0.79256169683E-01      
P   5
  1    236.58209146            -0.12271649354E-02      
  2     90.576183214           -0.92584627774E-02      
  3     39.086689301           -0.28428728384E-01      
  4      9.3084344018           0.21201102192    
  5      4.6169923084           0.47117589805    
P   1
  1      2.2653477506           1.0000000        
P   1
  1      1.0800000000           1.0000000        
P   1
  1      0.47939328581          1.0000000        
P   1
  1      0.19619983845          1.0000000        
P   1
  1      0.76256339275E-01            1.0000000        
D   7
  1    539.48700124             0.66722955533E-03      
  2    162.13394435             0.60399330928E-02      
  3     62.661795641            0.30238666507E-01      
  4     27.077272889            0.99267892065E-01      
  5     12.483003929            0.22358036310    
  6      5.8864623136           0.33574682762    
  7      2.7519131105           0.34554856483    
D   1
  1      1.2500769617           1.0000000        
D   1
  1      0.51172841843          1.0000000        
D   1
  1      0.2000000              1.0000000        
F   1
  1      0.28400000000          1.0000000        
F   1
  1      0.70970000000          1.0000000        
G   1
  1      0.57300000000          1.0000000        


name: Def2-QZVP
description: N/A
elt: Br
data:
BROMINE
S   11
  1 10629044.2640000            0.59322104325E-05      
  2 1591918.2739000             0.46118980689E-04      
  3 362333.9843700              0.24244612378E-03      
  4 102643.1114100              0.10231422748E-02      
  5  33489.8466680              0.37121984175E-02      
  6  12091.2471900              0.11978107933E-01      
  7   4716.1908789              0.34682692842E-01      
  8   1956.1598080              0.89068331264E-01      
  9    853.08595848             0.19330124567    
 10    387.96633666             0.32071144956    
 11    182.85156613             0.32996797574    
S   4
  1   3240.4086421              0.65905194070E-02      
  2   1000.4631935              0.68439609656E-01      
  3    383.37301682             0.34495478668    
  4    166.03929698             0.82315542085    
S   1
  1     87.919906994            1.0000000        
S   1
  1     35.675840068            1.0000000        
S   1
  1     17.543657842            1.0000000        
S   1
  1      8.4473660433           1.0000000        
S   1
  1      3.9666180616           1.0000000        
S   1
  1      1.8356815987           1.0000000        
S   1
  1      0.59084778776          1.0000000        
S   1
  1      0.28863218421          1.0000000        
S   1
  1      0.12153380537          1.0000000        
P   10
  1  26566.4765790              0.62073657410E-04      
  2   6290.5088566              0.55131636217E-03      
  3   2043.3178410              0.31680110980E-02      
  4    781.67221007             0.13816597290E-01      
  5    331.51078945             0.48018539681E-01      
  6    151.09198667             0.13162015183    
  7     72.395278166            0.26860052203    
  8     35.869510844            0.36827391093    
  9     18.139906191            0.27108612944    
 10      9.0466688944           0.76215338633E-01      
P   5
  1    253.71822146            -0.13729169381E-02      
  2     97.250818058           -0.10393811185E-01      
  3     42.034897960           -0.32204214612E-01      
  4      9.9685673555           0.24224770086    
  5      4.9395854745           0.53557868398    
P   1
  1      2.4382845475           1.0000000        
P   1
  1      1.1800000000           1.0000000        
P   1
  1      0.51047564965          1.0000000        
P   1
  1      0.21215851928          1.0000000        
P   1
  1      0.83943604990E-01            1.0000000        
D   7
  1    601.44434484             0.62783723765E-03      
  2    180.85718640             0.57205157153E-02      
  3     69.986806340            0.29002521527E-01      
  4     30.324710300            0.96446989766E-01      
  5     14.027909238            0.22065825870    
  6      6.6511702082           0.33657642375    
  7      3.1354168338           0.34872040582    
D   1
  1      1.4393591843           1.0000000        
D   1
  1      0.59350441438          1.0000000        
D   1
  1      0.2300000              1.0000000        
F   1
  1      0.34070000000          1.0000000        
F   1
  1      0.82570000000          1.0000000        
G   1
  1      0.64910000000          1.0000000        


name: Def2-QZVP
description: N/A
elt: Kr
data:
KRYPTON
S   11
  1 11713823.0080000            0.56915790360E-05      
  2 1755253.3979000             0.44214471278E-04      
  3 399717.4192400              0.23227813842E-03      
  4 113285.7926000              0.97973661050E-03      
  5  36977.2052930              0.35537627541E-02      
  6  13355.0365800              0.11468673282E-01      
  7   5210.9012988              0.33241627469E-01      
  8   2162.1137020              0.85620725674E-01      
  9    943.29291023             0.18708766876    
 10    429.20724331             0.31497583326    
 11    202.40720840             0.33406191042    
S   4
  1   3260.4985521              0.73091509287E-02      
  2   1011.1069716              0.74040355445E-01      
  3    392.44359273             0.35414962222    
  4    173.21702132             0.80188286115    
S   1
  1     96.619988467            1.0000000        
S   1
  1     38.158284867            1.0000000        
S   1
  1     18.959517570            1.0000000        
S   1
  1      9.2505996199           1.0000000        
S   1
  1      4.3486517621           1.0000000        
S   1
  1      2.0380324209           1.0000000        
S   1
  1      0.69110152540          1.0000000        
S   1
  1      0.33506065143          1.0000000        
S   1
  1      0.14074441124          1.0000000        
P   10
  1  28609.3357670              0.60526369543E-04      
  2   6773.1236364              0.53786288403E-03      
  3   2199.8011079              0.30935356550E-02      
  4    841.50201590             0.13514318412E-01      
  5    356.92110288             0.47090086910E-01      
  6    162.71174351             0.12960370449    
  7     78.004264994            0.26607435646    
  8     38.682579997            0.36775851233    
  9     19.589158685            0.27406903542    
 10      9.7990863417           0.78773352304E-01      
P   5
  1    261.37786869            -0.16397212361E-02      
  2    100.09932146            -0.12034797573E-01      
  3     44.012139363           -0.34891485263E-01      
  4     10.854010739            0.25212650561    
  5      5.4351930182           0.57400781830    
P   1
  1      2.7062805542           1.0000000        
P   1
  1      1.3195633408           1.0000000        
P   1
  1      0.58004455967          1.0000000        
P   1
  1      0.24329976264          1.0000000        
P   1
  1      0.96823725087E-01            1.0000000        
D   7
  1    665.35057386             0.59588702935E-03      
  2    200.17995366             0.54594260457E-02      
  3     77.545085570            0.27980992479E-01      
  4     33.677854345            0.94119165910E-01      
  5     15.624928334            0.21825215619    
  6      7.4427867423           0.33739971242    
  7      3.5336073535           0.35141418853    
D   1
  1      1.6363725142           1.0000000        
D   1
  1      0.67845684728          1.0000000        
D   1
  1      0.2700000              1.0000000        
F   1
  1      0.41300000000          1.0000000        
F   1
  1      0.95570000000          1.0000000        
G   1
  1      0.73950000000          1.0000000        


name: Def2-QZVP
description: N/A
elt: Rb
data:
RUBIDIUM
S   2
  1      7.4744618040           0.26999390986    
  2      6.7296180594          -0.42624989529    
S   1
  1      2.7822883445           1.0000000        
S   1
  1      0.53494544647          1.0000000        
S   1
  1      0.22522959349          1.0000000        
S   1
  1      0.50765580412E-01            1.0000000        
S   1
  1      0.26940281781E-01            1.0000000        
S   1
  1      0.13051395489E-01            1.0000000        
P   4
  1      5.9998960731           0.54568549670E-01      
  2      3.2040784712          -0.26447792498    
  3      0.86991979950          0.50033505958    
  4      0.44104169728          0.75243449327    
P   1
  1      0.22139898232          1.0000000        
P   1
  1      0.10679039696          1.0000000        
P   1
  1      0.33292658822E-01            1.0000000        
P   1
  1      0.12847003750E-01            1.0000000        
D   2
  1      4.6530655240          -0.11653388661E-02      
  2      0.44914033653          0.15584297068    
D   1
  1      0.10089577190          1.0000000        
D   1
  1      0.27432280711E-01            1.0000000        
D   1
  1      0.95353625581E-02            1.0000000        
F   1
  1      0.8524500              1.0000000        


name: Def2-QZVP
description: N/A
elt: Sr
data:
STRONTIUM
S   2
  1     11.000000000           -0.26157031021    
  2      9.9000000000           0.36446668395    
S   1
  1      2.8771178206           1.0000000        
S   1
  1      0.63364987829          1.0000000        
S   1
  1      0.28588739731          1.0000000        
S   1
  1      0.61938540840E-01            1.0000000        
S   1
  1      0.31237518881E-01            1.0000000        
S   1
  1      0.16266139051E-01            1.0000000        
P   4
  1      7.6233499793           0.71548409039E-01      
  2      3.6643075442          -0.44232262175    
  3      0.97809648234          0.55690782709    
  4      0.77815253363          0.63437348922    
P   1
  1      0.40666316828          1.0000000        
P   1
  1      0.18725455934          1.0000000        
P   1
  1      0.56304594427E-01            1.0000000        
P   1
  1      0.21826701680E-01            1.0000000        
D   2
  1      4.3003648126          -0.43567751655E-02      
  2      0.84876551534          0.13176477946    
D   1
  1      0.29200562252          1.0000000        
D   1
  1      0.94733990946E-01            1.0000000        
D   1
  1      0.30479894317E-01            1.0000000        
F   1
  1      0.9954000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Y
data:
YTTRIUM
S   2
  1     12.000000000           -0.27445870024    
  2     10.800000000            0.37995468727    
S   1
  1      3.1007372195           1.0000000        
S   1
  1      0.74155427570          1.0000000        
S   1
  1      0.34176775775          1.0000000        
S   1
  1      0.79428797018E-01            1.0000000        
S   1
  1      0.43308336524E-01            1.0000000        
S   1
  1      0.21593224872E-01            1.0000000        
P   4
  1      8.0336135138           0.73041700172E-01      
  2      4.0181723477          -0.41610436192    
  3      1.1052105890           0.55451897342    
  4      0.83219316692          0.62307196069    
P   1
  1      0.44762676666          1.0000000        
P   1
  1      0.20523347112          1.0000000        
P   1
  1      0.55045561759E-01            1.0000000        
P   1
  1      0.22603027453E-01            1.0000000        
D   4
  1     13.755105347            0.23830583863E-02      
  2      3.9629908552          -0.25068021047E-01      
  3      1.3427449755           0.22348991872    
  4      0.62579248108          0.55237929771    
D   1
  1      0.27632363958          1.0000000        
D   1
  1      0.11706987754          1.0000000        
D   1
  1      0.46601501035E-01            1.0000000        
F   1
  1      0.7629100              1.0000000        
F   1
  1      0.2651500              1.0000000        
F   1
  1      0.0921500              1.0000000        
G   1
  1      0.1114900              1.0000000        


name: Def2-QZVP
description: N/A
elt: Zr
data:
ZIRCONIUM
S   2
  1     13.000000000            0.30219052022    
  2     11.750000000           -0.41145056914    
S   1
  1      3.3679085035           1.0000000        
S   1
  1      0.83813257389          1.0000000        
S   1
  1      0.39094081796          1.0000000        
S   1
  1      0.12165103956          1.0000000        
S   1
  1      0.68995924030E-01            1.0000000        
S   1
  1      0.28131941438E-01            1.0000000        
P   4
  1      8.6639962104           0.73773984271E-01      
  2      4.4109566148          -0.40022747074    
  3      1.2360133871           0.54947233625    
  4      0.87445820593          0.61937721413    
P   1
  1      0.47713887642          1.0000000        
P   1
  1      0.21764845261          1.0000000        
P   1
  1      0.57837163627E-01            1.0000000        
P   1
  1      0.20242456645E-01            1.0000000        
D   4
  1     14.106535710            0.29285547494E-02      
  2      5.0597471810          -0.19680100129E-01      
  3      1.4340490314           0.24763912308    
  4      0.65933129072          0.53572735030    
D   1
  1      0.28894952351          1.0000000        
D   1
  1      0.12160731860          1.0000000        
D   1
  1      0.48470078407E-01            1.0000000        
F   1
  1      1.1417100              1.0000000        
F   1
  1      0.3926100              1.0000000        
F   1
  1      0.1350100              1.0000000        
G   1
  1      0.2898900              1.0000000        


name: Def2-QZVP
description: N/A
elt: Nb
data:
NIOBIUM
S   2
  1     13.500000000           -0.32410606901    
  2     12.200000000            0.44773333772    
S   1
  1      3.7169274051           1.0000000        
S   1
  1      0.90652488058          1.0000000        
S   1
  1      0.41577606051          1.0000000        
S   1
  1      0.11042511303          1.0000000        
S   1
  1      0.62821821279E-01            1.0000000        
S   1
  1      0.28016289999E-01            1.0000000        
P   4
  1      9.3098091725           0.73705483583E-01      
  2      4.8178682975          -0.38234456657    
  3      1.3632838380           0.54987821838    
  4      0.90647526151          0.61931035808    
P   1
  1      0.50089563075          1.0000000        
P   1
  1      0.22793279437          1.0000000        
P   1
  1      0.60000000000E-01            1.0000000        
P   1
  1      0.20600000000E-01            1.0000000        
D   4
  1     17.364404474            0.26413526976E-02      
  2      5.3680385855          -0.20806369564E-01      
  3      1.6586089067           0.24555637053    
  4      0.78121461396          0.53651499644    
D   1
  1      0.34874234803          1.0000000        
D   1
  1      0.14844540532          1.0000000        
D   1
  1      0.59334919015E-01            1.0000000        
F   1
  1      1.5360500              1.0000000        
F   1
  1      0.5227000              1.0000000        
F   1
  1      0.1778700              1.0000000        
G   1
  1      0.4682900              1.0000000        


name: Def2-QZVP
description: N/A
elt: Mo
data:
MOLYBDENUM
S   3
  1     15.000000000            0.57082903143E-01      
  2     13.500000000           -0.66824799324    
  3     12.571764111            0.75521146249    
S   1
  1      4.1304342348           1.0000000        
S   1
  1      0.96478113331          1.0000000        
S   1
  1      0.43736648981          1.0000000        
S   1
  1      0.11318605514          1.0000000        
S   1
  1      0.57579423658E-01            1.0000000        
S   1
  1      0.27018151462E-01            1.0000000        
P   4
  1      9.1087343439           0.10192125262    
  2      5.3495476626          -0.38460279534    
  3      1.4870196599           0.53457134734    
  4      0.90585473836          0.61724117143    
P   1
  1      0.50141240214          1.0000000        
P   1
  1      0.23286318145          1.0000000        
P   1
  1      0.62000000000E-01            1.0000000        
P   1
  1      0.21000000000E-01            1.0000000        
D   4
  1     17.215377137            0.30147475909E-02      
  2      5.8496916871          -0.28923836319E-01      
  3      1.8232967249           0.25398642015    
  4      0.86970233105          0.52725603860    
D   1
  1      0.39461697588          1.0000000        
D   1
  1      0.17084141240          1.0000000        
D   1
  1      0.69272819629E-01            1.0000000        
F   1
  1      1.9462500              1.0000000        
F   1
  1      0.6554500              1.0000000        
F   1
  1      0.2207400              1.0000000        
G   1
  1      0.6467000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Tc
data:
TECHNETIUM
S   3
  1     15.000000000           -0.31349221639    
  2     13.500000000            0.44793618799    
  3      7.1022525122           0.20051786822E-01      
S   1
  1      4.4415995038           1.0000000        
S   1
  1      1.0660127848           1.0000000        
S   1
  1      0.48568559673          1.0000000        
S   1
  1      0.12654965451          1.0000000        
S   1
  1      0.66997954399E-01            1.0000000        
S   1
  1      0.29822104753E-01            1.0000000        
P   4
  1     10.298029968            0.83867175334E-01      
  2      5.7213792785          -0.36246957884    
  3      1.6296063991           0.53649463822    
  4      0.97528623230          0.61837212480    
P   1
  1      0.53997625690          1.0000000        
P   1
  1      0.25172025379          1.0000000        
P   1
  1      0.64000000000E-01            1.0000000        
P   1
  1      0.21500000000E-01            1.0000000        
D   4
  1     18.617708386            0.27056783609E-02      
  2      5.8369803972          -0.35968645824E-01      
  3      2.0921979438           0.21334851537    
  4      1.0148117201           0.45713971996    
D   1
  1      0.46154215497          1.0000000        
D   1
  1      0.19795071041          1.0000000        
D   1
  1      0.78619872304E-01            1.0000000        
F   1
  1      2.3724000              1.0000000        
F   1
  1      0.7908000              1.0000000        
F   1
  1      0.2636000              1.0000000        
G   1
  1      0.8251000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ru
data:
RUTHENIUM
S   3
  1     15.000000000            0.40205707045    
  2     13.500000000           -0.59417167365    
  3      7.2130868530           0.12541032854    
S   1
  1      4.5405901225           1.0000000        
S   1
  1      1.1904973723           1.0000000        
S   1
  1      0.54307531590          1.0000000        
S   1
  1      0.13700563039          1.0000000        
S   1
  1      0.73396375028E-01            1.0000000        
S   1
  1      0.31250715458E-01            1.0000000        
P   4
  1     11.388100061            0.55871461629E-01      
  2      6.1591005666          -0.25808446847    
  3      1.7320431063           0.42924265341    
  4      1.0194857402           0.43313353048    
P   1
  1      0.58131419111          1.0000000        
P   1
  1      0.27290530268          1.0000000        
P   1
  1      0.66000000000E-01            1.0000000        
P   1
  1      0.22000000000E-01            1.0000000        
D   4
  1     18.598247778            0.31556859652E-02      
  2      6.7883773752          -0.34551060293E-01      
  3      2.2470797667           0.21708566158    
  4      1.0884195428           0.42834135307    
D   1
  1      0.49787892886          1.0000000        
D   1
  1      0.21481968266          1.0000000        
D   1
  1      0.85666751170E-01            1.0000000        
F   1
  1      2.8246600              1.0000000        
F   1
  1      0.9431400              1.0000000        
F   1
  1      0.3149100              1.0000000        
G   1
  1      1.0093000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Rh
data:
RHODIUM
S   3
  1     15.000000000            0.50258059140    
  2     13.500000000           -0.76433277918    
  3      7.4051116103           0.31145290674    
S   1
  1      4.5131696431           1.0000000        
S   1
  1      1.3235977422           1.0000000        
S   1
  1      0.60954144541          1.0000000        
S   1
  1      0.18907192773          1.0000000        
S   1
  1      0.89080450794E-01            1.0000000        
S   1
  1      0.34131567514E-01            1.0000000        
P   4
  1     11.839425278            0.59787418531E-01      
  2      6.6953652636          -0.24743454054    
  3      1.8333616287           0.42987003231    
  4      1.0267931770           0.42547313311    
P   1
  1      0.58071767020          1.0000000        
P   1
  1      0.27907753269          1.0000000        
P   1
  1      0.67108954625E-01            1.0000000        
P   1
  1      0.22101542156E-01            1.0000000        
D   4
  1     26.341167176            0.20623159685E-02      
  2      7.8709462705          -0.17239329053E-01      
  3      2.5989970939           0.17284839402    
  4      1.2613435752           0.36282102279    
D   1
  1      0.57578407979          1.0000000        
D   1
  1      0.24725174897          1.0000000        
D   1
  1      0.97531210324E-01            1.0000000        
F   1
  1      3.2739100              1.0000000        
F   1
  1      1.0949900              1.0000000        
F   1
  1      0.3662300              1.0000000        
G   1
  1      1.1935000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Pd
data:
PALLADIUM
S   3
  1     15.262399331            0.44145727454    
  2     13.721983176           -0.70293005979    
  3      4.8448286268           0.36095390108    
S   1
  1      8.7309326588           1.0000000        
S   1
  1      1.4357564094           1.0000000        
S   1
  1      0.66088433720          1.0000000        
S   1
  1      0.20897212790          1.0000000        
S   1
  1      0.91936735872E-01            1.0000000        
S   1
  1      0.34733479706E-01            1.0000000        
P   4
  1     12.585237008            0.60002003747E-01      
  2      7.2058104839          -0.24022183118    
  3      1.9558705640           0.43424940067    
  4      1.0534418618           0.42084436088    
P   1
  1      0.59809389552          1.0000000        
P   1
  1      0.30362411297          1.0000000        
P   1
  1      0.88000000000E-01            1.0000000        
P   1
  1      0.30000000000E-01            1.0000000        
D   4
  1     28.840985892            0.21131470308E-02      
  2      8.4584163440          -0.17913194955E-01      
  3      2.8648941754           0.17165507663    
  4      1.3966488847           0.36149251150    
D   1
  1      0.63921677230          1.0000000        
D   1
  1      0.27502319836          1.0000000        
D   1
  1      0.10829940074          1.0000000        
F   1
  1      3.7200000              1.0000000        
F   1
  1      1.2462900              1.0000000        
F   1
  1      0.4175400              1.0000000        
G   1
  1      1.3777000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ag
data:
SILVER
S   4
  1    256.50898381             0.73215128094E-03      
  2     19.000000000           -0.14706983774    
  3     14.129749737            0.47914881797    
  4      9.4840599768          -0.26930801705    
S   1
  1      5.5812682897           1.0000000        
S   1
  1      1.4763753299           1.0000000        
S   1
  1      0.66184584335          1.0000000        
S   1
  1      0.15382171742          1.0000000        
S   1
  1      0.79534248689E-01            1.0000000        
S   1
  1      0.32408624506E-01            1.0000000        
P   4
  1     13.350389537            0.62479151672E-01      
  2      7.7163302467          -0.24398688175    
  3      2.0864535219           0.45439758415    
  4      1.0577805733           0.47607485340    
P   1
  1      0.52564427657          1.0000000        
P   1
  1      0.23694908895          1.0000000        
P   1
  1      0.66457980332E-01            1.0000000        
P   1
  1      0.21864839286E-01            1.0000000        
D   4
  1     32.147961274            0.34564677092E-02      
  2      9.0323725307          -0.28135297216E-01      
  3      3.1673540854           0.26999486025    
  4      1.5519381135           0.57666767772    
D   1
  1      0.71310284000          1.0000000        
D   1
  1      0.30749741551          1.0000000        
D   1
  1      0.12094304210          1.0000000        
F   1
  1      4.1631100              1.0000000        
F   1
  1      1.3971100              1.0000000        
F   1
  1      0.4688600              1.0000000        
G   1
  1      1.5619000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Cd
data:
CADMIUM
S   4
  1    269.30016289             0.62688949336E-03      
  2     18.554269093           -0.43456616075    
  3     16.729943183            0.66043072415    
  4     11.768546646           -0.11793513277    
S   1
  1      6.1816604427           1.0000000        
S   1
  1      1.5775743989           1.0000000        
S   1
  1      0.71857981187          1.0000000        
S   1
  1      0.16433138409          1.0000000        
S   1
  1      0.76794158768E-01            1.0000000        
S   1
  1      0.34377199848E-01            1.0000000        
P   4
  1     14.107678180            0.70307291426E-01      
  2      8.2750040714          -0.26474818030    
  3      2.2507338323           0.47494851120    
  4      1.1914970238           0.46327020832    
P   1
  1      0.66041257699          1.0000000        
P   1
  1      0.33804403770          1.0000000        
P   1
  1      0.96004037879E-01            1.0000000        
P   1
  1      0.33681030012E-01            1.0000000        
D   4
  1     35.689192548            0.44455913982E-02      
  2      9.3407971610          -0.39185351747E-01      
  3      3.5922659140           0.31235972097    
  4      1.7980676976           0.71163739606    
D   1
  1      0.84830057791          1.0000000        
D   1
  1      0.37846492753          1.0000000        
D   1
  1      0.15420101631          1.0000000        
F   1
  1      4.7689900              1.0000000        
F   1
  1      1.5981300              1.0000000        
F   1
  1      0.5355500              1.0000000        
G   1
  1      1.7896000              1.0000000        


name: Def2-QZVP
description: N/A
elt: In
data:
INDIUM
S   9
  1   8931.8400000              0.19000000000E-04      
  2   1352.2200000              0.13100000000E-03      
  3    303.39300000             0.47800000000E-03      
  4     45.122900000            0.11708000000E-01      
  5     28.182200000           -0.87330000000E-01      
  6     17.604800000            0.25957700000    
  7      6.9405800000          -0.62847100000    
  8      4.3337700000          -0.15871800000    
  9      1.9868400000           0.67440400000    
S   3
  1     20.245544208            0.29650296199E-01      
  2     11.072298416           -0.14745372687    
  3      2.4929238916           0.53232061960    
S   1
  1      1.0438672413           1.0000000        
S   1
  1      0.53244484157          1.0000000        
S   1
  1      0.21211307407          1.0000000        
S   1
  1      0.95475196519E-01            1.0000000        
S   1
  1      0.42357644919E-01            1.0000000        
P   7
  1    129.23300000             0.27900000000E-03      
  2     29.628400000           -0.61710000000E-02      
  3     18.521100000            0.46912000000E-01      
  4      8.2853600000          -0.23990400000    
  5      2.4993900000           0.42981100000    
  6      1.3221600000           0.48610100000    
  7      0.68870700000          0.22203700000    
P   3
  1     13.248633034           -0.18203004609E-01      
  2      3.0240161259           0.31476939453    
  3      1.0805448379           0.71919648136    
P   1
  1      0.33353581509          1.0000000        
P   1
  1      0.15403760449          1.0000000        
P   1
  1      0.65770424632E-01            1.0000000        
P   1
  1      0.27642180293E-01            1.0000000        
D   8
  1    131.81131820             0.22281463414E-03      
  2     37.030875816            0.19331306797E-02      
  3     11.378665218           -0.17870304080E-01      
  4      6.4488212086           0.22953424346E-01      
  5      3.4878752216           0.17536747821    
  6      1.9912337572           0.29288830616    
  7      1.1306610212           0.31018960851    
  8      0.63074842914          0.24247651565    
D   1
  1      0.33856463907          1.0000000        
D   1
  1      0.17026198815          1.0000000        
D   1
  1      0.69200000000E-01            1.0000000        
F   1
  1      0.392100000            1.0000000        
F   1
  1      0.156000000            1.0000000        
F   1
  1      1.3983200000           1.0000000        
F   1
  1      4.1949600000           1.0000000        
G   1
  1      0.341900000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Sn
data:
TIN
S   9
  1  11606.9000000              0.29000000000E-04      
  2   1754.8000000              0.20600000000E-03      
  3    397.17800000             0.80700000000E-03      
  4     90.299000000            0.24710000000E-02      
  5     31.489000000           -0.40025000000E-01      
  6     19.668500000            0.16315200000    
  7      7.0675900000          -0.55698300000    
  8      4.4149000000          -0.16993200000    
  9      2.1635600000           0.65102800000    
S   3
  1     20.197961274            0.22393937317E-01      
  2     10.880108426           -0.14330764814    
  3      2.7745387028           0.53278527074    
S   1
  1      1.1440977736           1.0000000        
S   1
  1      0.58550056279          1.0000000        
S   1
  1      0.25317089836          1.0000000        
S   1
  1      0.11599461634          1.0000000        
S   1
  1      0.52233584109E-01            1.0000000        
P   7
  1    195.49500000             0.25800000000E-03      
  2     18.256300000            0.44341000000E-01      
  3     11.409400000           -0.10914200000    
  4      6.9056700000          -0.13860600000    
  5      2.9820600000           0.34374300000    
  6      1.6084300000           0.51827100000    
  7      0.83176700000          0.27870600000    
P   3
  1     13.304065745           -0.20694775410E-01      
  2      3.4193503621           0.33654593033    
  3      1.2382899573           0.71397757129    
P   1
  1      0.39265300321          1.0000000        
P   1
  1      0.19313059747          1.0000000        
P   1
  1      0.86443518729E-01            1.0000000        
P   1
  1      0.37350684674E-01            1.0000000        
D   8
  1    143.82134199             0.26165602862E-03      
  2     41.039940764            0.21562117321E-02      
  3     11.508999207           -0.24771286642E-01      
  4      8.4312612820           0.29022163379E-01      
  5      4.0180001346           0.16171344601    
  6      2.3122021836           0.29213521578    
  7      1.3168562511           0.32241037254    
  8      0.73729126651          0.24629433031    
D   1
  1      0.40109472811          1.0000000        
D   1
  1      0.20593354535          1.0000000        
D   1
  1      0.86600000000E-01            1.0000000        
F   1
  1      0.431500000            1.0000000        
F   1
  1      0.177200000            1.0000000        
F   1
  1      1.5915400000           1.0000000        
F   1
  1      4.7988893935           1.0000000        
G   1
  1      0.377400000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Sb
data:
ANTIMONY
S   9
  1  12339.3165550              0.38545231046E-04      
  2   1854.7043271              0.27702166404E-03      
  3    418.44441772             0.11161923778E-02      
  4     96.965111109            0.28828055377E-02      
  5     28.537960267           -0.60556405021E-01      
  6     17.862907144            0.27988835315    
  7      8.4541754812          -0.54748479396    
  8      5.2813981306          -0.30336289748    
  9      2.3194618632           0.68093278701    
S   3
  1     25.336266601            0.22414355064E-01      
  2     12.477043309           -0.14737811818    
  3      3.0723142741           0.53278468779    
S   1
  1      1.2167512076           1.0000000        
S   1
  1      0.60174774699          1.0000000        
S   1
  1      0.28323936354          1.0000000        
S   1
  1      0.13221765728          1.0000000        
S   1
  1      0.60986718951E-01            1.0000000        
P   7
  1    162.89300000             0.37500000000E-03      
  2     30.399600000           -0.47980000000E-02      
  3     19.000400000            0.54731000000E-01      
  4      9.3225600000          -0.25528400000    
  5      3.0166800000           0.34537700000    
  6      1.8621900000           0.40483300000    
  7      1.1033100000           0.32592200000    
P   3
  1     12.665326113           -0.20694788562E-01      
  2      3.3473442879           0.26878411014    
  3      1.1722158971           0.72590523998    
P   1
  1      0.58886745483          1.0000000        
P   1
  1      0.25014249608          1.0000000        
P   1
  1      0.11120161090          1.0000000        
P   1
  1      0.48206685448E-01            1.0000000        
D   8
  1    142.61790051             0.34691704136E-03      
  2     40.920334292            0.27417583490E-02      
  3     10.854520545           -0.33847404142E-01      
  4      8.3926457719           0.42753986065E-01      
  5      4.1806878019           0.16545099365    
  6      2.5346474124           0.26821979719    
  7      1.5175455555           0.31482077294    
  8      0.86799625994          0.25485913704    
D   1
  1      0.47323070711          1.0000000        
D   1
  1      0.24111763234          1.0000000        
D   1
  1      0.10080000000          1.0000000        
F   1
  1      0.484900000            1.0000000        
F   1
  1      0.204900000            1.0000000        
F   1
  1      1.7880600000           1.0000000        
F   1
  1      5.6265581363           1.0000000        
G   1
  1      0.423400000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Te
data:
TELLURIUM
S   9
  1  15746.3000000              0.54000000000E-04      
  2   2369.2500000              0.39800000000E-03      
  3    535.86000000             0.16620000000E-02      
  4    141.88500000             0.36360000000E-02      
  5     27.819700000           -0.58427000000E-01      
  6     17.387900000            0.36652000000    
  7     10.865600000           -0.39758900000    
  8      6.5688500000          -0.51917500000    
  9      2.4013900000           0.68765200000    
S   3
  1     29.383253023            0.30079778033E-01      
  2     15.946408003           -0.13631630929    
  3      3.6679902632           0.53467574034    
S   1
  1      1.2865441585           1.0000000        
S   1
  1      0.63533594694          1.0000000        
S   1
  1      0.29807786206          1.0000000        
S   1
  1      0.14061248688          1.0000000        
S   1
  1      0.65660655893E-01            1.0000000        
P   7
  1    750.22200000             0.52000000000E-04      
  2    163.96100000             0.41000000000E-03      
  3     16.922700000            0.83387000000E-01      
  4     10.575500000           -0.26821200000    
  5      5.7046200000          -0.22932000000E-01      
  6      2.9802200000           0.49554800000    
  7      1.5197000000           0.51452200000    
P   3
  1     13.925457258           -0.21336842159E-01      
  2      4.2323766654           0.22433961554    
  3      1.4547630727           0.73198528158    
P   1
  1      0.75528783692          1.0000000        
P   1
  1      0.31829451168          1.0000000        
P   1
  1      0.13721830923          1.0000000        
P   1
  1      0.57099171462E-01            1.0000000        
D   8
  1    146.30727119             0.43816018982E-03      
  2     42.243859354            0.33559305599E-02      
  3      9.9155377745          -0.11157186771    
  4      8.9949643607           0.13269569633    
  5      4.1376628430           0.21574044755    
  6      2.3659339431           0.32583679541    
  7      1.3736141857           0.30685918052    
  8      0.79846379228          0.19445241192    
D   1
  1      0.45685175394          1.0000000        
D   1
  1      0.25022747959          1.0000000        
D   1
  1      0.11560000000          1.0000000        
F   1
  1      0.518400000            1.0000000        
F   1
  1      0.213500000            1.0000000        
F   1
  1      1.9347800000           1.0000000        
F   1
  1      5.8043400000           1.0000000        
G   1
  1      0.429400000            1.0000000        


name: Def2-QZVP
description: N/A
elt: I
data:
IODINE
S   9
  1  16788.4000000              0.41000000000E-04      
  2   2526.6400000              0.30300000000E-03      
  3    571.98400000             0.12470000000E-02      
  4    150.43400000             0.26590000000E-02      
  5     29.540500000           -0.53190000000E-01      
  6     18.457100000            0.34009600000    
  7     11.528600000           -0.35235500000    
  8      7.0828900000          -0.54138500000    
  9      2.5040500000           0.71574900000    
S   3
  1     25.058617933            0.40897754402E-01      
  2     15.621979372           -0.14269668187    
  3      3.3536325162           0.52916319279    
S   1
  1      1.3540144781           1.0000000        
S   1
  1      0.67430472704          1.0000000        
S   1
  1      0.32727136949          1.0000000        
S   1
  1      0.15749364119          1.0000000        
S   1
  1      0.74377727841E-01            1.0000000        
P   7
  1    656.27400000             0.91000000000E-04      
  2    149.23200000             0.61300000000E-03      
  3     19.015300000            0.59923000000E-01      
  4     10.737800000           -0.24925800000    
  5      6.4420800000          -0.43750000000E-02      
  6      3.0920300000           0.51399900000    
  7      1.5787400000           0.50721300000    
P   3
  1     15.660511893           -0.22143803592E-01      
  2      4.9250669812           0.23518064355    
  3      1.6692319982           0.73153925548    
P   1
  1      0.77817898176          1.0000000        
P   1
  1      0.35608843716          1.0000000        
P   1
  1      0.15493242649          1.0000000        
P   1
  1      0.64666212492E-01            1.0000000        
D   8
  1    318.22407776             0.10951692560E-03      
  2     95.810227352            0.91919139268E-03      
  3     35.322295259            0.47916935207E-02      
  4     13.107447819           -0.16280459996E-01      
  5      6.2949152988           0.90889609141E-01      
  6      3.6826101201           0.27483543784    
  7      2.0858950647           0.36067901632    
  8      1.1644342344           0.28384002219    
D   1
  1      0.63180613129          1.0000000        
D   1
  1      0.32215084697          1.0000000        
D   1
  1      0.13490000000          1.0000000        
F   1
  1      0.587800000            1.0000000        
F   1
  1      0.250000000            1.0000000        
F   1
  1      2.1780000000           1.0000000        
F   1
  1      6.4253613600           1.0000000        
G   1
  1      0.473900000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Xe
data:
XENON
S   9
  1  18774.3000000              0.68000000000E-04      
  2   2824.8100000              0.50100000000E-03      
  3    640.08800000             0.20970000000E-02      
  4    172.61600000             0.44930000000E-02      
  5     29.516900000           -0.47151000000E-01      
  6     18.444800000            0.37403300000    
  7     11.523800000           -0.51282600000    
  8      6.6189000000          -0.47862400000    
  9      2.9955200000           0.59647100000    
S   3
  1     27.052171835            0.11189611954    
  2     20.940622415           -0.24055422724    
  3      6.0024591071           0.51452076187    
S   1
  1      1.6532586536           1.0000000        
S   1
  1      0.87553889270          1.0000000        
S   1
  1      0.41033616654          1.0000000        
S   1
  1      0.19493585779          1.0000000        
S   1
  1      0.90171093041E-01            1.0000000        
P   7
  1    613.33100000             0.13800000000E-03      
  2    141.71000000             0.85300000000E-03      
  3     20.310600000            0.55024000000E-01      
  4     11.033100000           -0.25298800000    
  5      6.8951300000           0.97460000000E-02      
  6      3.2416600000           0.52679700000    
  7      1.6653500000           0.50183200000    
P   3
  1     18.388908413           -0.24514446229E-01      
  2      6.1139045431           0.25265669670    
  3      1.8729815691           0.72938328969    
P   1
  1      0.82004665991          1.0000000        
P   1
  1      0.39552648254          1.0000000        
P   1
  1      0.17445509815          1.0000000        
P   1
  1      0.73389992663E-01            1.0000000        
D   8
  1    315.66106865             0.14235585191E-03      
  2     95.553873651            0.11707875751E-02      
  3     35.451236301            0.58783160362E-02      
  4     13.153211283           -0.16764226287E-01      
  5      6.3847329564           0.11558421625    
  6      3.6968166410           0.30375919653    
  7      2.0976070364           0.36037726827    
  8      1.1951246616           0.24813434400    
D   1
  1      0.68431725339          1.0000000        
D   1
  1      0.37710480204          1.0000000        
D   1
  1      0.16760000000          1.0000000        
F   1
  1      0.661900000            1.0000000        
F   1
  1      0.297900000            1.0000000        
F   1
  1      2.4323000000           1.0000000        
F   1
  1      7.2077391789           1.0000000        
G   1
  1      0.527800000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Cs
data:
CESIUM
S   3
  1      5.8684829520           0.12906631816    
  2      4.3741038860          -0.34380446158    
  3      1.7951201473           0.69937346606    
S   1
  1      0.37816941125          1.0000000        
S   1
  1      0.16624693130          1.0000000        
S   1
  1      0.27763176052E-01            1.0000000        
S   1
  1      0.16113005842E-01            1.0000000        
S   1
  1      0.10996108743E-01            1.0000000        
P   3
  1      4.2749775718           0.45595316685E-01      
  2      1.9639316240          -0.25031125651    
  3      0.47666322385          0.55660114378    
P   1
  1      0.21736718772          1.0000000        
P   1
  1      0.97276293828E-01            1.0000000        
P   1
  1      0.26770518041E-01            1.0000000        
P   1
  1      0.10845412222E-01            1.0000000        
D   2
  1      2.0091044335          -0.34453182058E-02      
  2      0.35778351451          0.22686596025    
D   1
  1      0.11070568254          1.0000000        
D   1
  1      0.33216214821E-01            1.0000000        
D   1
  1      0.11409380652E-01            1.0000000        
F   1
  1      0.5877700              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ba
data:
BARIUM
S   2
  1      5.7000000000           1.3292982002     
  2      5.2043612469          -1.7367497134     
S   1
  1      2.1475437282           1.0000000        
S   1
  1      0.41033660537          1.0000000        
S   1
  1      0.18393532770          1.0000000        
S   1
  1      0.72521216545E-01            1.0000000        
S   1
  1      0.34526334903E-01            1.0000000        
S   1
  1      0.16157891872E-01            1.0000000        
P   4
  1      5.6000000000           0.51385026013    
  2      5.1104879274          -0.70529238864    
  3      2.5006544803           0.42822329830    
  4      0.51947995345         -0.57125984472    
P   1
  1      0.24536994841          1.0000000        
P   1
  1      0.11256056700          1.0000000        
P   1
  1      0.34917622027E-01            1.0000000        
P   1
  1      0.16320065666E-01            1.0000000        
D   3
  1      2.7000000000           0.14372069823827 
  2      2.3460740881          -0.19565347309413 
  3      0.39553542609          0.29963058551591 
D   1
  1      0.12967935859          1.0000000        
D   1
  1      0.40463066544E-01            1.0000000        
F   1
  1      0.6576000              1.0000000        


name: Def2-QZVP
description: N/A
elt: La
data:
LANTHANUM
S   3
  1     26.077272000            0.23198684846E-02      
  2      5.7127838000          -0.29787719611    
  3      4.4057848000           0.70022722515    
S   1
  1      2.1315325829           1.0000000        
S   1
  1      0.49385808956          1.0000000        
S   1
  1      0.23595687888          1.0000000        
S   1
  1      0.63593489661E-01            1.0000000        
S   1
  1      0.31545394754E-01            1.0000000        
S   1
  1      0.15777655296E-01            1.0000000        
P   4
  1      6.0000000000          -0.11397960924E-01      
  2      3.6808191615           0.14675038550    
  3      2.3265462081          -0.35581819167    
  4      0.64342629633          0.45834955229    
P   1
  1      0.33584281962          1.0000000        
P   1
  1      0.16519051916          1.0000000        
P   1
  1      0.56715971797E-01            1.0000000        
P   1
  1      0.22100824776E-01            1.0000000        
D   3
  1      1.2000000000          -0.35803482414    
  2      1.0239524401           0.40483734122    
  3      0.37508490282          0.37649639849    
D   1
  1      0.17161940245          1.0000000        
D   1
  1      0.78780423402E-01            1.0000000        
D   1
  1      0.35000047794E-01            1.0000000        
F   1
  1      0.6558000              1.0000000        
F   1
  1      0.2568300              1.0000000        
F   1
  1      0.1005800              1.0000000        
G   1
  1      0.1790700              1.0000000        


name: Def2-QZVP
description: N/A
elt: Hf
data:
HAFNIUM
S   4
  1     24.000000000            0.19369448644    
  2     16.000000000           -3.5064630782     
  3     14.400000000            4.3082581000     
  4     10.304504667           -0.91045809742    
S   1
  1      3.8372797792           1.0000000        
S   1
  1      0.94649028050          1.0000000        
S   1
  1      0.44397931299          1.0000000        
S   1
  1      0.13656009445          1.0000000        
S   1
  1      0.66549732509E-01            1.0000000        
S   1
  1      0.28719110054E-01            1.0000000        
P   4
  1     17.000000000           -0.30316491880E-01      
  2     11.738072097            0.10139279686    
  3      4.9203967161          -0.28227924657    
  4      1.1251726138           0.52032008501    
P   1
  1      0.54220114055          1.0000000        
P   1
  1      0.25659447877          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
D   3
  1      6.9644775309           0.90606952386E-01      
  2      5.7275227587          -0.16459899714    
  3      1.1503305416           0.51375718250    
D   1
  1      0.47559482991          1.0000000        
D   1
  1      0.18774414759          1.0000000        
D   1
  1      0.68439488104E-01            1.0000000        
F   1
  1      0.8038700              1.0000000        
F   1
  1      0.3154700              1.0000000        
F   1
  1      0.1238000              1.0000000        
G   1
  1      0.2903600              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ta
data:
TANTALUM
S   4
  1     24.473650944            0.20537515818    
  2     18.721372549           -0.74477445680    
  3     11.500000000            3.4067771001     
  4     10.350000000           -2.8222400335     
S   1
  1      3.8125414615           1.0000000        
S   1
  1      1.0507430630           1.0000000        
S   1
  1      0.49732275755          1.0000000        
S   1
  1      0.15602650970          1.0000000        
S   1
  1      0.75056442354E-01            1.0000000        
S   1
  1      0.31632668803E-01            1.0000000        
P   4
  1     17.000000000           -0.32577305616E-01      
  2     12.008186536            0.10336287365    
  3      5.0278760583          -0.28526521696    
  4      1.1937124184           0.51790141155    
P   1
  1      0.57889707053          1.0000000        
P   1
  1      0.27225198801          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
D   3
  1      7.1419762952           0.88606814221E-01      
  2      5.7696869171          -0.17156962221    
  3      1.2199483941           0.53547693505    
D   1
  1      0.52366034246          1.0000000        
D   1
  1      0.21384808767          1.0000000        
D   1
  1      0.80254256735E-01            1.0000000        
F   1
  1      0.9507000              1.0000000        
F   1
  1      0.3738600              1.0000000        
F   1
  1      0.1470200              1.0000000        
G   1
  1      0.4016500              1.0000000        


name: Def2-QZVP
description: N/A
elt: W
data:
TUNGSTEN
S   4
  1     22.106487883            0.66320504570    
  2     18.958062620           -1.5576189160     
  3     13.128699049            2.1416485467     
  4     10.149417378           -1.1823364947     
S   1
  1      4.0160322414           1.0000000        
S   1
  1      1.1234496158           1.0000000        
S   1
  1      0.53500662821          1.0000000        
S   1
  1      0.17127449658          1.0000000        
S   1
  1      0.80452897876E-01            1.0000000        
S   1
  1      0.33669872229E-01            1.0000000        
P   4
  1     17.000000000           -0.37817768433E-01      
  2     12.431973432            0.10905673845    
  3      5.1586217658          -0.29399955020    
  4      1.2801454812           0.51560726697    
P   1
  1      0.62856790898          1.0000000        
P   1
  1      0.29380423553          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
D   3
  1      7.4064737315           0.86993963018E-01      
  2      5.9026268603          -0.17667540011    
  3      1.2984756750           0.55145697030    
D   1
  1      0.57153508541          1.0000000        
D   1
  1      0.23845526606          1.0000000        
D   1
  1      0.91144267331E-01            1.0000000        
F   1
  1      1.0962400              1.0000000        
F   1
  1      0.4319900              1.0000000        
F   1
  1      0.1702300              1.0000000        
G   1
  1      0.5129300              1.0000000        


name: Def2-QZVP
description: N/A
elt: Re
data:
RHENIUM
S   4
  1     24.000000000            0.26968047163    
  2     18.204262749           -1.3559378623     
  3     14.048192487            1.9003709759     
  4      9.5166786954          -0.75626964015    
S   1
  1      4.1714667981           1.0000000        
S   1
  1      1.1944213976           1.0000000        
S   1
  1      0.56755447797          1.0000000        
S   1
  1      0.17533854868          1.0000000        
S   1
  1      0.82014250464E-01            1.0000000        
S   1
  1      0.34607892740E-01            1.0000000        
P   4
  1     18.000000000           -0.26890962397E-01      
  2     12.318606250            0.99711498502E-01      
  3      5.3719234505          -0.29289398145    
  4      1.3506646748           0.51466301434    
P   1
  1      0.66212816808          1.0000000        
P   1
  1      0.31071385193          1.0000000        
P   1
  1      0.10800000000          1.0000000        
P   1
  1      0.45000000000E-01            1.0000000        
D   3
  1      7.7352877672           0.83901798556E-01      
  2      6.0949443610          -0.17722258734    
  3      1.3871105497           0.55238259692    
D   1
  1      0.62324027854          1.0000000        
D   1
  1      0.26517328547          1.0000000        
D   1
  1      0.10321096849          1.0000000        
F   1
  1      1.2406000              1.0000000        
F   1
  1      0.4898900              1.0000000        
F   1
  1      0.1934500              1.0000000        
G   1
  1      0.6242200              1.0000000        


name: Def2-QZVP
description: N/A
elt: Os
data:
OSMIUM
S   4
  1     24.000000000            0.24559132972    
  2     18.204262749           -1.3020204925     
  3     14.048192487            1.9114896000     
  4      9.5166786954          -0.83098846799    
S   1
  1      4.2529406042           1.0000000        
S   1
  1      1.2999583502           1.0000000        
S   1
  1      0.61756850127          1.0000000        
S   1
  1      0.18785305474          1.0000000        
S   1
  1      0.87865523960E-01            1.0000000        
S   1
  1      0.37004242944E-01            1.0000000        
P   4
  1     15.500000000            0.16016463376    
  2     14.000000000           -0.23201520402    
  3      5.5458290420           0.29772587274    
  4      1.4139502215          -0.54253238176    
P   1
  1      0.68136686765          1.0000000        
P   1
  1      0.30911452647          1.0000000        
P   1
  1      0.90000000000E-01            1.0000000        
P   1
  1      0.33000000000E-01            1.0000000        
D   3
  1      8.5557226523           0.55081304746E-01      
  2      6.1927250845          -0.15041777374    
  3      1.4916733698           0.55087247584    
D   1
  1      0.67423241512          1.0000000        
D   1
  1      0.28635737076          1.0000000        
D   1
  1      0.11074292707          1.0000000        
F   1
  1      1.3802600              1.0000000        
F   1
  1      0.5506500              1.0000000        
F   1
  1      0.2196800              1.0000000        
G   1
  1      0.7548900              1.0000000        


name: Def2-QZVP
description: N/A
elt: Ir
data:
IRIDIUM
S   4
  1     23.465507222            0.71085679679    
  2     20.657091116           -1.5723547785     
  3     15.725107858            1.2938086001     
  4      7.9297463605          -0.42980466966    
S   1
  1      4.5196120103           1.0000000        
S   1
  1      1.3392891402           1.0000000        
S   1
  1      0.63692276928          1.0000000        
S   1
  1      0.19126770642          1.0000000        
S   1
  1      0.87881999015E-01            1.0000000        
S   1
  1      0.37643105533E-01            1.0000000        
P   4
  1     15.902664143           -0.16290720099    
  2     14.415830698            0.23483212987    
  3      5.7597608991          -0.30305337176    
  4      1.5008913108           0.55512982069    
P   1
  1      0.72348035957          1.0000000        
P   1
  1      0.32785980328          1.0000000        
P   1
  1      0.91000000000E-01            1.0000000        
P   1
  1      0.35000000000E-01            1.0000000        
D   3
  1      8.9686781612           0.29754685954E-01      
  2      6.4456319498          -0.82246052942E-01      
  3      1.5835819740           0.29212392062    
D   1
  1      0.71871917882          1.0000000        
D   1
  1      0.30539233284          1.0000000        
D   1
  1      0.11791405498          1.0000000        
F   1
  1      1.5134800              1.0000000        
F   1
  1      0.6100800              1.0000000        
F   1
  1      0.2459200              1.0000000        
G   1
  1      0.8855600              1.0000000        


name: Def2-QZVP
description: N/A
elt: Pt
data:
PLATINUM
S   4
  1     23.465507222            0.55150926143    
  2     20.657091116           -1.2690274107     
  3     15.725107858            1.1215145470     
  4      7.9297463605          -0.42250178029    
S   1
  1      4.6667116243           1.0000000        
S   1
  1      1.4202522633           1.0000000        
S   1
  1      0.66786671541          1.0000000        
S   1
  1      0.19745059689          1.0000000        
S   1
  1      0.92573920368E-01            1.0000000        
S   1
  1      0.38895936899E-01            1.0000000        
P   4
  1     15.500000000           -0.15672718629    
  2     14.000000000            0.23853412989    
  3      6.1161212339          -0.31041379733    
  4      1.5715586385           0.56473525089    
P   1
  1      0.75132510781          1.0000000        
P   1
  1      0.33306466812          1.0000000        
P   1
  1      0.91000000000E-01            1.0000000        
P   1
  1      0.35000000000E-01            1.0000000        
D   3
  1      8.3207937611           0.62945508668E-01      
  2      7.4207226520          -0.90271154330E-01      
  3      1.6570410639           0.16812340903    
D   1
  1      0.73943569960          1.0000000        
D   1
  1      0.30508290090          1.0000000        
D   1
  1      0.11350435924          1.0000000        
F   1
  1      1.6402500              1.0000000        
F   1
  1      0.6681300              1.0000000        
F   1
  1      0.2721500              1.0000000        
G   1
  1      1.0162300              1.0000000        


name: Def2-QZVP
description: N/A
elt: Au
data:
GOLD
S   3
  1     24.200000000            1.4645004443     
  2     22.000000000           -3.9770190496     
  3     20.000000000            2.7298033533     
S   1
  1      5.4043553001           1.0000000        
S   1
  1      1.4532546773           1.0000000        
S   1
  1      0.68294298420          1.0000000        
S   1
  1      0.19002755303          1.0000000        
S   1
  1      0.88155981740E-01            1.0000000        
S   1
  1      0.37739555187E-01            1.0000000        
P   4
  1     15.500000000            0.15001711880    
  2     14.000000000           -0.23609813183    
  3      6.4227368205           0.31458896948    
  4      1.6595601681          -0.57279670446    
P   1
  1      0.79402913993          1.0000000        
P   1
  1      0.35125155397          1.0000000        
P   1
  1      0.81000000000E-01            1.0000000        
P   1
  1      0.25000000000E-01            1.0000000        
D   3
  1      8.6000000000           0.15361654684    
  2      7.8531899379          -0.20443530663    
  3      1.7650856798           0.30781811607    
D   1
  1      0.79482263260          1.0000000        
D   1
  1      0.33085396360          1.0000000        
D   1
  1      0.12398535801          1.0000000        
F   1
  1      1.7607400              1.0000000        
F   1
  1      0.7248200              1.0000000        
F   1
  1      0.2983800              1.0000000        
G   1
  1      1.1469000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Hg
data:
MERCURY
S   3
  1     48.013786990            0.56241403333E-02      
  2     21.239875095           -0.17054083503    
  3     15.876100879            0.35940389661    
S   1
  1      5.4865939429           1.0000000        
S   1
  1      1.5521766895           1.0000000        
S   1
  1      0.74742541187          1.0000000        
S   1
  1      0.20268838483          1.0000000        
S   1
  1      0.93376229211E-01            1.0000000        
S   1
  1      0.41248705609E-01            1.0000000        
P   4
  1     17.500000000           -0.86457187331E-01      
  2     15.252594855            0.15327318234    
  3      6.4404715169          -0.30274955249    
  4      1.8180159920           0.54361285026    
P   1
  1      0.90067981801          1.0000000        
P   1
  1      0.41304540122          1.0000000        
P   1
  1      0.11845702655          1.0000000        
P   1
  1      0.36087619349E-01            1.0000000        
D   4
  1     11.888648987            0.13311219898E-01      
  2      6.7773660954          -0.73346199848E-01      
  3      2.0934941340           0.24155986719    
  4      1.0817087176           0.38865972362    
D   1
  1      0.53329136060          1.0000000        
D   1
  1      0.24984101827          1.0000000        
D   1
  1      0.10879770063          1.0000000        
F   1
  1      1.8893800              1.0000000        
F   1
  1      0.7956900              1.0000000        
F   1
  1      0.3351000              1.0000000        
G   1
  1      1.2895000              1.0000000        


name: Def2-QZVP
description: N/A
elt: Tl
data:
THALLIUM
S   9
  1   9675.5500000              0.80000000000E-05      
  2   1471.4800000              0.57000000000E-04      
  3    323.64800000             0.22700000000E-03      
  4     33.807900000            0.21666000000E-01      
  5     21.131600000           -0.19589700000    
  6     13.209100000            0.67362000000    
  7      8.2561100000          -0.57167600000    
  8      5.1001400000          -0.61234400000    
  9      1.8194300000           0.75954400000    
S   3
  1     13.432924081            0.16050252545    
  2     11.126956705           -0.25827112953    
  3      2.0351129325           0.52570088358    
S   1
  1      0.96804610176          1.0000000        
S   1
  1      0.47288027019          1.0000000        
S   1
  1      0.21703241765          1.0000000        
S   1
  1      0.99551664344E-01            1.0000000        
S   1
  1      0.44674475181E-01            1.0000000        
P   7
  1     42.524000000            0.16050000000E-02      
  2     21.395700000           -0.23159000000E-01      
  3     13.373700000            0.11173800000    
  4      6.6133700000          -0.34647200000    
  5      2.0421700000           0.47507300000    
  6      1.1144900000           0.48633500000    
  7      0.59800600000          0.20513900000    
P   3
  1      9.0557032031          -0.57376712693E-01      
  2      3.9424773914           0.27305802340    
  3      1.2382159385           0.72255078460    
P   1
  1      0.29943260745          1.0000000        
P   1
  1      0.14250182360          1.0000000        
P   1
  1      0.61655072518E-01            1.0000000        
P   1
  1      0.26054870511E-01            1.0000000        
D   7
  1     63.792149375            0.19539028558E-03      
  2     10.854099697            0.17775848298E-01      
  3      6.3885280565          -0.89213657526E-01      
  4      2.4120875010           0.18424406191    
  5      1.4246170706           0.30659722011    
  6      0.83496548780          0.31018961556    
  7      0.48634320397          0.23215648111    
D   1
  1      0.27592111650          1.0000000        
D   1
  1      0.14737244064          1.0000000        
D   1
  1      0.67700000000E-01            1.0000000        
F   1
  1      0.426300000            1.0000000        
F   1
  1      0.169000000            1.0000000        
F   1
  1      1.0848100000           1.0000000        
F   1
  1      2.3083704534           1.0000000        
G   1
  1      0.369300000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Pb
data:
LEAD
S   9
  1   9368.3300000              0.14000000000E-04      
  2   1366.9300000              0.10300000000E-03      
  3    299.68200000             0.37900000000E-03      
  4     34.859700000            0.23274000000E-01      
  5     21.788900000           -0.20343600000    
  6     13.620000000            0.69921400000    
  7      8.5129500000          -0.60684100000    
  8      5.3033200000          -0.61139200000    
  9      1.9281600000           0.76522700000    
S   3
  1     13.559944213            0.15955164155    
  2     11.039620045           -0.26750615828    
  3      2.1371722788           0.52500552105    
S   1
  1      1.0373400312           1.0000000        
S   1
  1      0.51111685694          1.0000000        
S   1
  1      0.24673987563          1.0000000        
S   1
  1      0.11577976738          1.0000000        
S   1
  1      0.52874167812E-01            1.0000000        
P   7
  1     59.090100000            0.71600000000E-03      
  2     20.919700000           -0.21082000000E-01      
  3     13.077700000            0.12706100000    
  4      6.8991000000          -0.37228400000    
  5      2.1962700000           0.43566300000    
  6      1.3048600000           0.43573500000    
  7      0.77957200000          0.26094700000    
P   3
  1      9.1373183134          -0.55319030476E-01      
  2      3.9570574249           0.27275707058    
  3      1.2246639098           0.72280340692    
P   1
  1      0.42601564238          1.0000000        
P   1
  1      0.20378586294          1.0000000        
P   1
  1      0.88168647885E-01            1.0000000        
P   1
  1      0.37094701422E-01            1.0000000        
D   7
  1     66.348248961            0.28507140251E-03      
  2     13.455899798            0.93352787747E-02      
  3      6.5510273149          -0.75354763534E-01      
  4      2.6574136949           0.16674578725    
  5      1.6001278005           0.31208757936    
  6      0.93304454981          0.32900401823    
  7      0.54391365526          0.22655044022    
D   1
  1      0.32059545270          1.0000000        
D   1
  1      0.17922304239          1.0000000        
D   1
  1      0.83200000000E-01            1.0000000        
F   1
  1      0.441300000            1.0000000        
F   1
  1      0.178200000            1.0000000        
F   1
  1      1.1606000000           1.0000000        
F   1
  1      2.5184938758           1.0000000        
G   1
  1      0.388100000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Bi
data:
BISMUTH
S   9
  1   8131.0900000              0.29000000000E-04      
  2   1225.7700000              0.20000000000E-03      
  3    274.67200000             0.68400000000E-03      
  4     37.616400000            0.20218000000E-01      
  5     23.480400000           -0.15932600000    
  6     14.106500000            0.61172600000    
  7      8.8130500000          -0.54465300000    
  8      5.5077800000          -0.63688400000    
  9      2.0397700000           0.77169800000    
S   3
  1     13.614284474            0.15800789319    
  2     11.010881766           -0.27164962692    
  3      2.2630089550           0.52469330212    
S   1
  1      1.0975227257           1.0000000        
S   1
  1      0.52344449532          1.0000000        
S   1
  1      0.26734409206          1.0000000        
S   1
  1      0.12836608814          1.0000000        
S   1
  1      0.60097735551E-01            1.0000000        
P   7
  1     99.591400000            0.34600000000E-03      
  2     19.896400000           -0.19976000000E-01      
  3     12.437600000            0.17544600000    
  4      7.7740000000          -0.37955600000    
  5      4.8399500000          -0.55262000000E-01      
  6      2.2547800000           0.52888400000    
  7      1.1804900000           0.52132400000    
P   3
  1      9.6213214965          -0.52920356623E-01      
  2      4.1321350830           0.26705180214    
  3      1.2785827783           0.72824686940    
P   1
  1      0.59423596262          1.0000000        
P   1
  1      0.25794168858          1.0000000        
P   1
  1      0.11273595358          1.0000000        
P   1
  1      0.47791974731E-01            1.0000000        
D   7
  1     69.632799181            0.35055800732E-03      
  2     14.888614968            0.81591735697E-02      
  3      6.5949628713          -0.83905319526E-01      
  4      4.1796107640           0.28034212952E-01      
  5      2.5697950152           0.20202314185    
  6      1.5601364822           0.33621249652    
  7      0.89210528768          0.34629017140    
D   1
  1      0.48093728228          1.0000000        
D   1
  1      0.24233621968          1.0000000        
D   1
  1      0.10440000000          1.0000000        
F   1
  1      0.480300000            1.0000000        
F   1
  1      0.200600000            1.0000000        
F   1
  1      1.2625600000           1.0000000        
F   1
  1      2.7210175470           1.0000000        
G   1
  1      0.420300000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Po
data:
POLONIUM
S   9
  1   8913.2900000              0.47000000000E-04      
  2   1338.9800000              0.33100000000E-03      
  3    299.53800000             0.11610000000E-02      
  4     51.148900000            0.78990000000E-02      
  5     23.015600000           -0.14934700000    
  6     14.376500000            0.63824200000    
  7      8.9827900000          -0.61708300000    
  8      5.6129200000          -0.60519700000    
  9      2.1648400000           0.77608600000    
S   3
  1     14.787766907            0.15929033129    
  2     11.958781204           -0.27310166985    
  3      2.4798455066           0.52423698726    
S   1
  1      1.1753800000           1.0000000        
S   1
  1      0.55481477792          1.0000000        
S   1
  1      0.28581735198          1.0000000        
S   1
  1      0.13849439468          1.0000000        
S   1
  1      0.64954523837E-01            1.0000000        
P   7
  1    113.55700000             0.38700000000E-03      
  2     20.363900000           -0.18255000000E-01      
  3     12.727400000            0.17477600000    
  4      7.9498400000          -0.39870300000    
  5      4.9647700000          -0.31812000000E-01      
  6      2.3013000000           0.56604700000    
  7      1.1954500000           0.51022200000    
P   3
  1      8.4681300000          -0.23853762000    
  2      7.7962017000           0.28579119000    
  3      0.66871758000          0.46050656000    
P   1
  1      0.59152423927          1.0000000        
P   1
  1      0.24444843795          1.0000000        
P   1
  1      0.11018922460          1.0000000        
P   1
  1      0.48149776000E-01            1.0000000        
D   7
  1     73.649818245            0.43310334585847D-03      
  2     16.743441686            0.69436968591148D-02      
  3      5.8163048812          -0.83799240387068 
  4      5.6493757173           0.79372183416095 
  5      2.4547686106           0.29055549251205 
  6      1.3909015593           0.38177920669704 
  7      0.78934505572          0.29342954207529 
D   1
  1      0.44107648549          1.0000000        
D   1
  1      0.23631248810          1.0000000        
D   1
  1      0.10930000000          1.0000000        
F   1
  1      0.489400000            1.0000000        
F   1
  1      0.200200000            1.0000000        
F   1
  1      1.3122000000           1.0000000        
F   1
  1      2.8220658714           1.0000000        
G   1
  1      0.407400000            1.0000000        


name: Def2-QZVP
description: N/A
elt: At
data:
ASTATINE
S   9
  1   9090.2800000              0.35000000000E-04      
  2   1373.0700000              0.24200000000E-03      
  3    307.95000000             0.81500000000E-03      
  4     48.017600000            0.84650000000E-02      
  5     23.909900000           -0.14733300000    
  6     14.933400000            0.63241500000    
  7      9.3317100000          -0.61640600000    
  8      5.8320600000          -0.61925800000    
  9      2.2878700000           0.78512400000    
S   3
  1     14.805780876            0.15771473639    
  2     11.855783628           -0.28007490839    
  3      2.5818782360           0.52359428906    
S   1
  1      1.2537238008           1.0000000        
S   1
  1      0.61460691976          1.0000000        
S   1
  1      0.31486716636          1.0000000        
S   1
  1      0.15441669153          1.0000000        
S   1
  1      0.72866424566E-01            1.0000000        
P   7
  1    124.60200000             0.46800000000E-03      
  2     20.889900000           -0.16124000000E-01      
  3     13.058500000            0.17119600000    
  4      8.1606100000          -0.40887500000    
  5      5.0980800000          -0.16407000000E-01      
  6      2.3787600000           0.58817200000    
  7      1.2375500000           0.50099700000    
P   3
  1      8.7977584321          -0.23832810213    
  2      8.0996431502           0.28585830834    
  3      0.67629719775          0.46050935965    
P   1
  1      0.60785017930          1.0000000        
P   1
  1      0.26116561417          1.0000000        
P   1
  1      0.11948611257          1.0000000        
P   1
  1      0.52899086095E-01            1.0000000        
D   7
  1     76.152584155            0.54645145370E-03      
  2     17.982092186            0.70498116717E-02      
  3      5.8900316564          -0.59711331046    
  4      5.6001503121           0.56517203927    
  5      2.4782622062           0.32344318344    
  6      1.3928750256           0.39511263456    
  7      0.78560551382          0.27094838862    
D   1
  1      0.44173978741          1.0000000        
D   1
  1      0.24984733563          1.0000000        
D   1
  1      0.12700000000          1.0000000        
F   1
  1      0.538900000            1.0000000        
F   1
  1      0.228700000            1.0000000        
F   1
  1      1.4237200000           1.0000000        
F   1
  1      3.0086421207           1.0000000        
G   1
  1      0.436300000            1.0000000        


name: Def2-QZVP
description: N/A
elt: Rn
data:
RADON
S   9
  1  12715.6000000              0.47000000000E-04      
  2   1913.3000000              0.33800000000E-03      
  3    429.95600000             0.12800000000E-02      
  4    100.97800000             0.27820000000E-02      
  5     24.470800000           -0.10042100000    
  6     15.292200000            0.53982400000    
  7      9.5548300000          -0.57385600000    
  8      5.9666100000          -0.61000000000    
  9      2.3893900000           0.79325300000    
S   3
  1     17.195195341            0.16333005101    
  2     14.230303720           -0.27167744770    
  3      3.0760339153           0.52372666490    
S   1
  1      1.3276477516           1.0000000        
S   1
  1      0.69973866760          1.0000000        
S   1
  1      0.33174234887          1.0000000        
S   1
  1      0.16093431878          1.0000000        
S   1
  1      0.75883596172E-01            1.0000000        
P   7
  1    131.70800000             0.58500000000E-03      
  2     21.401600000           -0.14438000000E-01      
  3     13.382600000            0.17009500000    
  4      8.3688000000          -0.42250400000    
  5      5.2294500000          -0.17190000000E-02      
  6      2.4768500000           0.60115800000    
  7      1.3018000000           0.49278000000    
P   3
  1      9.0768547920          -0.23950411879    
  2      8.3822367043           0.28554010268    
  3      0.70618692299          0.46017587936    
P   1
  1      0.64553860374          1.0000000        
P   1
  1      0.28380500916          1.0000000        
P   1
  1      0.13160518578          1.0000000        
P   1
  1      0.58958259826E-01            1.0000000        
D   8
  1    183.73000000             0.12900000000E-03      
  2     54.689700000            0.94900000000E-03      
  3     16.425500000            0.10100000000E-01      
  4      7.3050000000          -0.87309000000E-01      
  5      4.2747700000           0.71452000000E-01      
  6      2.6114200000           0.29537800000    
  7      1.5667400000           0.35873100000    
  8      0.96097900000          0.25612000000    
D   1
  1      0.59653500000          1.0000000        
D   1
  1      0.34202800000          1.0000000        
D   1
  1      0.15160000000          1.0000000        
F   1
  1      0.594000000            1.0000000        
F   1
  1      0.268400000            1.0000000        
F   1
  1      1.5556400000           1.0000000        
F   1
  1      3.2498641894           1.0000000        
G   1
  1      0.476300000            1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: H
data:
HYDROGEN
S   4
  1    190.69169000             0.70815167000E-03      
  2     28.605532000            0.54678827000E-02      
  3      6.5095943000           0.27966605000E-01      
  4      1.8412455000           0.10764538000    
S   1
  1      0.59853725000          1.0000000        
S   1
  1      0.21397624000          1.0000000        
S   1
  1      0.80316286000E-01            1.0000000        
P   1
  1      2.2920000000           1.0000000        
P   1
  1      0.83800000000          1.0000000        
P   1
  1      0.29200000000          1.0000000        
P   1
  1      0.84063199228E-01            1.0000000        
D   1
  1      2.0620000000           1.0000000        
D   1
  1      0.66200000000          1.0000000        
F   1
  1      1.3970000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: He
data:
HELIUM
S   5
  1   1144.6470809              0.35861578618E-03      
  2    171.64596667             0.27725434466E-02      
  3     39.066056254            0.14241892216E-01      
  4     11.051401989            0.55457352277E-01      
  5      3.5725574473           0.16170511810    
S   1
  1      1.2429415962           1.0000000        
S   1
  1      0.44807668730          1.0000000        
S   1
  1      0.16411579128          1.0000000        
P   1
  1      5.9940000000           1.0000000        
P   1
  1      1.7450000000           1.0000000        
P   1
  1      0.56000000000          1.0000000        
P   1
  1      0.16298923122          1.0000000        
D   1
  1      4.2990000000           1.0000000        
D   1
  1      1.2230000000           1.0000000        
F   1
  1      2.6800000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Li
data:
LITHIUM
S   9
  1  14853.9770850              0.42711388815E-04      
  2   2225.2236477              0.33235310800E-03      
  3    504.88739008             0.17518436649E-02      
  4    142.45847548             0.73477995850E-02      
  5     46.315599580            0.25899837683E-01      
  6     16.655335474            0.76670682431E-01      
  7      6.4331186199           0.18276075765    
  8      2.6027043858           0.32655434038    
  9      1.0897245405           0.37000429828    
S   2
  1      4.4236595971           0.11120987921    
  2      1.2356394990           0.79987335862    
S   1
  1      0.46067470602          1.0000000        
S   1
  1      0.96617166955E-01            1.0000000        
S   1
  1      0.45915452296E-01            1.0000000        
S   1
  1      0.21140048730E-01            1.0000000        
P   3
  1      3.2605109206           0.86504749023E-02      
  2      0.65003043115          0.47614123736E-01      
  3      0.16941671073          0.21001138000    
P   1
  1      0.55732343767E-01            1.0000000        
P   1
  1      0.20489959241E-01            1.0000000        
P   1
  1      3.3270000000           1.0000000        
D   1
  1      0.23000000000          1.0000000        
D   1
  1      0.75700000000E-01            1.0000000        
F   1
  1      0.13500000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Be
data:
BERYLLIUM
S   8
  1  29646.7044070              0.37943320869E-04      
  2   4428.7614354              0.29605352634E-03      
  3   1005.4701332              0.15572477356E-02      
  4    284.15339578             0.65323195769E-02      
  5     92.504356461            0.23116861005E-01      
  6     33.311016058            0.69458515249E-01      
  7     12.911553314            0.17014371331    
  8      5.2665497361           0.31682711374    
S   2
  1     22.995386380            0.81791122747E-01      
  2      6.6236354176           0.80000038023    
S   1
  1      2.2289595003           1.0000000        
S   1
  1      0.95302433451          1.0000000        
S   1
  1      0.24651602436          1.0000000        
S   1
  1      0.10153895315          1.0000000        
S   1
  1      0.41551374604E-01            1.0000000        
P   4
  1     14.099789445            0.38508871145E-02      
  2      3.1803188482           0.24152380771E-01      
  3      0.90489220496          0.97926925156E-01      
  4      0.30411585508          0.29470380030    
P   1
  1      0.11302606657          1.0000000        
P   1
  1      0.42831733691E-01            1.0000000        
P   1
  1      6.4000000000           1.0000000        
D   1
  1      0.36000000000          1.0000000        
D   1
  1      0.90000000000E-01            1.0000000        
F   1
  1      0.29000000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: B
data:
BORON
S   8
  1  46447.6670560              0.38388681014E-04      
  2   6957.6889042              0.29836770197E-03      
  3   1583.4428403              0.15645478806E-02      
  4    448.46601009             0.65476770742E-02      
  5    146.28639262             0.23139008388E-01      
  6     52.784386084            0.69615799357E-01      
  7     20.519396170            0.17119636876    
  8      8.4185659258           0.31913191837    
S   2
  1     36.510018312            0.78990617244E-01      
  2     10.541854005            0.78926384265    
S   1
  1      3.6004091387           1.0000000        
S   1
  1      1.5617023749           1.0000000        
S   1
  1      0.44997370775          1.0000000        
S   1
  1      0.18075230237          1.0000000        
S   1
  1      0.71596696319E-01            1.0000000        
S   1
  1      0.29941402533E-01            1.0000000        
P   5
  1     72.240462760            0.86539170411E-03      
  2     16.807707208            0.68762067365E-02      
  3      5.2259410747           0.30976687148E-01      
  4      1.8508350671           0.10432357913    
  5      0.72206782663          0.26164137577    
P   1
  1      0.29491018056          1.0000000        
P   1
  1      0.12201141839          1.0000000        
P   1
  1      0.49865393625E-01            1.0000000        
D   1
  1      1.1100000000           1.0000000        
D   1
  1      0.40200000000          1.0000000        
D   1
  1      0.14500000000          1.0000000        
D   1
  1      0.50896593879E-01            1.0000000        
F   1
  1      0.88200000000          1.0000000        
F   1
  1      0.31100000000          1.0000000        
G   1
  1      0.67300000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: C
data:
CARBON
S   8
  1  67025.0710290              0.38736308501E-04      
  2  10039.9865380              0.30107917575E-03      
  3   2284.9316911              0.15787918095E-02      
  4    647.14122130             0.66087087195E-02      
  5    211.09472335             0.23367123250E-01      
  6     76.177643862            0.70420716898E-01      
  7     29.633839163            0.17360344953    
  8     12.187785081            0.32292305648    
S   2
  1     53.026006299            0.74897404492E-01      
  2     15.258502776            0.76136220983    
S   1
  1      5.2403957464           1.0000000        
S   1
  1      2.2905022379           1.0000000        
S   1
  1      0.69673283006          1.0000000        
S   1
  1      0.27599337363          1.0000000        
S   1
  1      0.10739884389          1.0000000        
S   1
  1      0.44981404899E-01            1.0000000        
P   5
  1    105.12555082             0.84647553844E-03      
  2     24.884461066            0.66274038534E-02      
  3      7.8637230826           0.30120390419E-01      
  4      2.8407001835           0.99951435476E-01      
  5      1.1227137335           0.23826299282    
P   1
  1      0.46050725555          1.0000000        
P   1
  1      0.18937530913          1.0000000        
P   1
  1      0.75983791611E-01            1.0000000        
D   1
  1      1.8480000000           1.0000000        
D   1
  1      0.64900000000          1.0000000        
D   1
  1      0.22800000000          1.0000000        
D   1
  1      0.76889830417E-01            1.0000000        
F   1
  1      1.4190000000           1.0000000        
F   1
  1      0.48500000000          1.0000000        
G   1
  1      1.0110000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: N
data:
NITROGEN
S   8
  1  90726.8892100              0.39257887368E-04      
  2  13590.5288010              0.30513316455E-03      
  3   3092.9883781              0.16000560446E-02      
  4    875.99876362             0.66982937306E-02      
  5    285.74469982             0.23690078765E-01      
  6    103.11913417             0.71455405268E-01      
  7     40.128556777            0.17632774876    
  8     16.528095704            0.32677592815    
S   2
  1     69.390960983            0.80052094386E-01      
  2     20.428200596            0.78268063538    
S   1
  1      7.1292587972           1.0000000        
S   1
  1      3.1324304893           1.0000000        
S   1
  1      0.98755778723          1.0000000        
S   1
  1      0.38765721307          1.0000000        
S   1
  1      0.14909883075          1.0000000        
S   1
  1      0.62151630318E-01            1.0000000        
P   5
  1    150.05742670            -0.86216165986E-03      
  2     35.491599483           -0.68571273236E-02      
  3     11.247864223           -0.31795688855E-01      
  4      4.0900305195          -0.10537396822    
  5      1.6220573146          -0.24519708041    
P   1
  1      0.66442261530          1.0000000        
P   1
  1      0.27099770070          1.0000000        
P   1
  1      0.10688749984          1.0000000        
D   1
  1      2.8370000000           1.0000000        
D   1
  1      0.96800000000          1.0000000        
D   1
  1      0.33500000000          1.0000000        
D   1
  1      0.10825280010          1.0000000        
F   1
  1      2.0270000000           1.0000000        
F   1
  1      0.68500000000          1.0000000        
G   1
  1      1.4270000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: O
data:
OXYGEN
S   8
  1 116506.4690800              0.40383857939E-04      
  2  17504.3497240              0.31255139004E-03      
  3   3993.4513230              0.16341473495E-02      
  4   1133.0063186              0.68283224757E-02      
  5    369.99569594             0.24124410221E-01      
  6    133.62074349             0.72730206154E-01      
  7     52.035643649            0.17934429892    
  8     21.461939313            0.33059588895    
S   2
  1     89.835051252            0.96468652996E-01      
  2     26.428010844            0.94117481120    
S   1
  1      9.2822824649           1.0000000        
S   1
  1      4.0947728533           1.0000000        
S   1
  1      1.3255349078           1.0000000        
S   1
  1      0.51877230787          1.0000000        
S   1
  1      0.19772676454          1.0000000        
S   1
  1      0.69638535104E-01            1.0000000        
P   5
  1    191.15255810             0.25115697705E-02      
  2     45.233356739            0.20039240864E-01      
  3     14.353465922            0.93609064762E-01      
  4      5.2422371832           0.30618127124    
  5      2.0792418599           0.67810501439    
P   1
  1      0.84282371424          1.0000000        
P   1
  1      0.33617694891          1.0000000        
P   1
  1      0.12863997974          1.0000000        
P   1
  1      0.43598162776E-01            1.0000000        
D   1
  1      3.7750000000           1.0000000        
D   1
  1      1.3000000000           1.0000000        
D   1
  1      0.44400000000          1.0000000        
D   1
  1      0.12546378695          1.0000000        
F   1
  1      2.6660000000           1.0000000        
F   1
  1      0.85900000000          1.0000000        
G   1
  1      1.8460000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: F
data:
FLUORINE
S   8
  1 132535.9734500              0.47387482743E-04      
  2  19758.1125880              0.37070120897E-03      
  3   4485.1996947              0.19450784713E-02      
  4   1273.8151020              0.80573291994E-02      
  5    418.93831236             0.27992880781E-01      
  6    152.55721985             0.82735120175E-01      
  7     59.821524823            0.19854169012    
  8     24.819076932            0.34860632233    
S   2
  1    100.74446673             0.10505068816    
  2     30.103728290            0.94068472434    
S   1
  1     10.814283272            1.0000000        
S   1
  1      4.8172886770           1.0000000        
S   1
  1      1.6559334213           1.0000000        
S   1
  1      0.64893519582          1.0000000        
S   1
  1      0.24778104545          1.0000000        
S   1
  1      0.87626236800E-01            1.0000000        
P   5
  1    240.96654114             0.30389933451E-02      
  2     57.020699781            0.24357738582E-01      
  3     18.126952120            0.11442925768    
  4      6.6457404621           0.37064659853    
  5      2.6375722892           0.79791551766    
P   1
  1      1.0638217200           1.0000000        
P   1
  1      0.41932562750          1.0000000        
P   1
  1      0.15747588299          1.0000000        
P   1
  1      0.46772400332E-01            1.0000000        
D   1
  1      5.0140000000           1.0000000        
D   1
  1      1.7250000000           1.0000000        
D   1
  1      0.58600000000          1.0000000        
D   1
  1      0.15967986245          1.0000000        
F   1
  1      3.5620000000           1.0000000        
F   1
  1      1.1480000000           1.0000000        
G   1
  1      2.3760000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ne
data:
NEON
S   8
  1 160676.2795500              0.47387482743E-04      
  2  23953.1950390              0.37070120897E-03      
  3   5437.5063711              0.19450784713E-02      
  4   1544.2741024              0.80573291994E-02      
  5    507.88814269             0.27992880781E-01      
  6    184.94847750             0.82735120175E-01      
  7     72.522952039            0.19854169012    
  8     30.088713575            0.34860632233    
S   2
  1    120.68434940             0.10400597014    
  2     36.074294857            0.91999988986    
S   1
  1     13.052091210            1.0000000        
S   1
  1      5.7974783353           1.0000000        
S   1
  1      2.0478626895           1.0000000        
S   1
  1      0.80214571994          1.0000000        
S   1
  1      0.30548672205          1.0000000        
S   1
  1      0.10621243030          1.0000000        
P   6
  1    498.43397466             0.43118261050E-03      
  2    118.14109217             0.36206397703E-02      
  3     38.032529735            0.18245344081E-01      
  4     14.183731950            0.65133035572E-01      
  5      5.7864190721           0.16708915089    
  6      2.4599622160           0.29268019613    
P   1
  1      1.0421999498           1.0000000        
P   1
  1      0.42987748916          1.0000000        
P   1
  1      0.16889708453          1.0000000        
P   1
  1      0.47169461232E-01            1.0000000        
D   1
  1      6.4710000000           1.0000000        
D   1
  1      2.2130000000           1.0000000        
D   1
  1      0.74700000000          1.0000000        
D   1
  1      0.19790459442          1.0000000        
F   1
  1      4.6570000000           1.0000000        
F   1
  1      1.5240000000           1.0000000        
G   1
  1      2.9830000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Na
data:
SODIUM
S   10
  1 379852.2008100              0.20671384468E-04      
  2  56886.0063780              0.16070466617E-03      
  3  12942.7018380              0.84462905848E-03      
  4   3664.3017904              0.35519026029E-02      
  5   1194.7417499              0.12754034468E-01      
  6    430.98192917             0.39895462742E-01      
  7    167.83169424             0.10720154498    
  8     69.306669040            0.23339516913    
  9     29.951170886            0.36333077287    
 10     13.380791097            0.30544770974    
S   3
  1    121.74011283             0.36142427284E-01      
  2     37.044143387            0.28820961687    
  3     13.995422624            0.79337384869    
S   1
  1      5.9827797428           1.0000000        
S   1
  1      2.4830455118           1.0000000        
S   1
  1      1.0452506187           1.0000000        
S   1
  1      0.43875640383          1.0000000        
S   1
  1      0.65595633185E-01            1.0000000        
S   1
  1      0.30561925072E-01            1.0000000        
S   1
  1      0.15509064018E-01            1.0000000        
P   8
  1    690.77627017             0.37478518415E-03      
  2    163.82806121             0.31775441030E-02      
  3     52.876460769            0.16333581338E-01      
  4     19.812270493            0.59754902585E-01      
  5      8.1320378784           0.15879328812    
  6      3.4969068377           0.29049363260    
  7      1.5117244146           0.36368131139    
  8      0.64479294912          0.28195867334    
P   1
  1      0.26145823312          1.0000000        
P   1
  1      0.11704726116          1.0000000        
P   1
  1      0.40494747666E-01            1.0000000        
P   1
  1      0.15666707355E-01            1.0000000        
D   1
  1      2.9000000000           1.0000000        
D   1
  1      0.23000000000          1.0000000        
D   1
  1      0.75700000000E-01            1.0000000        
F   1
  1      0.13500000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Mg
data:
MAGNESIUM
S   10
  1 605967.7875300              0.14430176617E-04      
  2  90569.0946920              0.11249871807E-03      
  3  20574.2528440              0.59264972450E-03      
  4   5818.6284865              0.24988770424E-02      
  5   1895.6296075              0.90230775141E-02      
  6    683.45941021             0.28579919806E-01      
  7    266.18219762             0.79064453923E-01      
  8    110.11220010             0.18269337814    
  9     47.777041234            0.32157193967    
 10     21.542166149            0.35028259389    
S   3
  1    174.12136378             0.22931111278E-01      
  2     53.484972498            0.19151777552    
  3     20.500213307            0.61155711055    
S   1
  1      9.8056826922           1.0000000        
S   1
  1      3.5402989348           1.0000000        
S   1
  1      1.5450850046           1.0000000        
S   1
  1      0.66540195432          1.0000000        
S   1
  1      0.14355439071          1.0000000        
S   1
  1      0.66624673468E-01            1.0000000        
S   1
  1      0.29772648266E-01            1.0000000        
P   8
  1    893.20460829             0.34958267428E-03      
  2    211.78258286             0.29811890111E-02      
  3     68.443200537            0.15517845758E-01      
  4     25.727265349            0.57578659557E-01      
  5     10.606634281            0.15610307853    
  6      4.5934126484           0.29230912580    
  7      2.0100469807           0.37219024072    
  8      0.87384841536          0.27578088891    
P   1
  1      0.35615076666          1.0000000        
P   1
  1      0.18995954356          1.0000000        
P   1
  1      0.74580135669E-01            1.0000000        
P   1
  1      0.29221641309E-01            1.0000000        
D   1
  1      3.8100000000           1.0000000        
D   1
  1      0.65000000000          1.0000000        
D   1
  1      0.20000000000          1.0000000        
D   1
  1      0.52000000000E-01            1.0000000        
F   1
  1      0.16000000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Al
data:
ALUMINUM
S   10
  1 754550.7826500              0.13421335886E-04      
  2 112999.3892200              0.10433210786E-03      
  3  25715.8317590              0.54841772080E-03      
  4   7283.6030283              0.23089081391E-02      
  5   2376.0008796              0.83309974593E-02      
  6    857.65468087             0.26417963653E-01      
  7    334.38922598             0.73443646426E-01      
  8    138.48504731             0.17184039139    
  9     60.150368808            0.31041980030    
 10     27.127610860            0.35669190596    
S   3
  1    225.36500065             0.21522039783E-01      
  2     69.341968124            0.18531780493    
  3     26.619335712            0.63533181245    
S   1
  1     12.349420671            1.0000000        
S   1
  1      4.5878785994           1.0000000        
S   1
  1      2.0571338103           1.0000000        
S   1
  1      0.90864549395          1.0000000        
S   1
  1      0.24226988038          1.0000000        
S   1
  1      0.11248136869          1.0000000        
S   1
  1      0.48156492817E-01            1.0000000        
S   1
  1      0.21134849794E-01            1.0000000        
P   8
  1   1489.6119522              0.20177122443E-03      
  2    353.01399267             0.17508109203E-02      
  3    114.40764069             0.94424704664E-02      
  4     43.312186111            0.36868004006E-01      
  5     18.027322216            0.10892874007    
  6      7.9675432403           0.23265901004    
  7      3.6090399541           0.34643587076    
  8      1.6456081630           0.33440809866    
P   2
  1     34.731187489            0.17823073020E-01      
  2      1.2553083630          -0.59991263926    
P   1
  1      0.73635534282          1.0000000        
P   1
  1      0.24686465559          1.0000000        
P   1
  1      0.94821971828E-01            1.0000000        
P   1
  1      0.36214165654E-01            1.0000000        
D   1
  1      1.9700000000           1.0000000        
D   1
  1      0.43700000000          1.0000000        
D   1
  1      0.19500000000          1.0000000        
D   1
  1      0.80000000000E-01            1.0000000        
D   1
  1      0.30664004967E-01            1.0000000        
F   1
  1      0.15400000000          1.0000000        
F   1
  1      0.40100000000          1.0000000        
G   1
  1      0.35700000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Si
data:
SILICON
S   10
  1 918070.6956500              0.12658787192E-04      
  2 137485.2538600              0.98408387461E-04      
  3  31287.7727140              0.51731398244E-03      
  4   8861.6105697              0.21785441933E-02      
  5   2890.6943156              0.78656853716E-02      
  6   1043.4063979              0.24987553674E-01      
  7    406.80160276             0.69761818844E-01      
  8    168.48360207             0.16473362733    
  9     73.185628823            0.30285602647    
 10     32.998485420            0.36007260439    
S   3
  1    278.78751325             0.20185463814E-01      
  2     85.910228722            0.17720406747    
  3     32.992604031            0.63587860906    
S   1
  1     15.033693254            1.0000000        
S   1
  1      5.7257514773           1.0000000        
S   1
  1      2.6146521029           1.0000000        
S   1
  1      1.1757833152           1.0000000        
S   1
  1      0.35432330868          1.0000000        
S   1
  1      0.16248335806          1.0000000        
S   1
  1      0.68332457181E-01            1.0000000        
S   1
  1      0.30521078871E-01            1.0000000        
P   8
  1   1775.8850516              0.20186971126E-03      
  2    420.83786849             0.17544314655E-02      
  3    136.42290243             0.95039532290E-02      
  4     51.700991737            0.37325741590E-01      
  5     21.559456002            0.11085396329    
  6      9.5559200095           0.23756407046    
  7      4.3529819473           0.35295783750    
  8      2.0096964381           0.32885931947    
P   2
  1     46.418153780            0.25858819154E-01      
  2      1.9076417796          -0.59874865899    
P   1
  1      0.92337221587          1.0000000        
P   1
  1      0.34515720370          1.0000000        
P   1
  1      0.13656834761          1.0000000        
P   1
  1      0.52987060586E-01            1.0000000        
D   1
  1      2.6450000000           1.0000000        
D   1
  1      0.60800000000          1.0000000        
D   1
  1      0.27200000000          1.0000000        
D   1
  1      0.11300000000          1.0000000        
D   1
  1      0.44018904228E-01            1.0000000        
F   1
  1      0.21200000000          1.0000000        
F   1
  1      0.54100000000          1.0000000        
G   1
  1      0.46100000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: P
data:
PHOSPHOROUS
S   10
  1 1090561.7138000             0.12142449664E-04      
  2 163316.3946100              0.94395292614E-04      
  3  37166.6074510              0.49622262177E-03      
  4  10526.8809450              0.20900040747E-02      
  5   3433.9976028              0.75489230025E-02      
  6   1239.5360480              0.24010423937E-01      
  7    483.27456199             0.67231473697E-01      
  8    200.16911586             0.15978669881    
  9     86.960394829            0.29735906782    
 10     39.211283369            0.36187171850    
S   3
  1    336.75883662             0.19154721050E-01      
  2    103.72179793             0.17134079100    
  3     39.771861240            0.63689655985    
S   1
  1     17.888612952            1.0000000        
S   1
  1      6.9644556879           1.0000000        
S   1
  1      3.2198092087           1.0000000        
S   1
  1      1.4669943979           1.0000000        
S   1
  1      0.47765437532          1.0000000        
S   1
  1      0.21637789241          1.0000000        
S   1
  1      0.90235894336E-01            1.0000000        
S   1
  1      0.40836372978E-01            1.0000000        
P   8
  1   2019.6711374              0.21359172406E-03      
  2    478.60125090             0.18568771399E-02      
  3    155.14942504             0.10070690115E-01      
  4     58.816356575            0.39605153679E-01      
  5     24.544512785            0.11736067844    
  6     10.883571061            0.24950540642    
  7      4.9624791285           0.36421287984    
  8      2.3002912343           0.31764127123    
P   2
  1     59.371345016            0.39432918004    
  2      3.0694590986          -6.3522960431     
P   1
  1      1.0634401739           1.0000000        
P   1
  1      0.45022152161          1.0000000        
P   1
  1      0.18267271344          1.0000000        
P   1
  1      0.71610333771E-01            1.0000000        
D   1
  1      3.3430000000           1.0000000        
D   1
  1      0.80700000000          1.0000000        
D   1
  1      0.36500000000          1.0000000        
D   1
  1      0.15400000000          1.0000000        
D   1
  1      0.59687731846E-01            1.0000000        
F   1
  1      0.28000000000          1.0000000        
F   1
  1      0.70300000000          1.0000000        
G   1
  1      0.59700000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: S
data:
SULFUR
S   10
  1 1273410.9023000             0.11767088246E-04      
  2 190697.8300700              0.91478610166E-04      
  3  43397.8853300              0.48090078640E-03      
  4  12291.8096770              0.20257193592E-02      
  5   4009.7420824              0.73190096406E-02      
  6   1447.3531030              0.23300499900E-01      
  7    564.30102913             0.65386213610E-01      
  8    233.74506243             0.15614449910    
  9    101.56402814             0.29318563787    
 10     45.805907187            0.36287914289    
S   3
  1    394.27281503             0.18753305081E-01      
  2    121.72249591             0.16870726663    
  3     46.754125963            0.63806830653    
S   1
  1     20.923008254            1.0000000        
S   1
  1      8.2685567800           1.0000000        
S   1
  1      3.8629345671           1.0000000        
S   1
  1      1.7794684781           1.0000000        
S   1
  1      0.61064260103          1.0000000        
S   1
  1      0.27412269445          1.0000000        
S   1
  1      0.11325939107          1.0000000        
S   1
  1      0.44392624881E-01            1.0000000        
P   8
  1   2189.8930459              0.23912552864E-03      
  2    518.94596592             0.20772032158E-02      
  3    168.19560151             0.11242420571E-01      
  4     63.745282788            0.44069933941E-01      
  5     26.597033077            0.12918778608    
  6     11.774251449            0.26910820167    
  7      5.3534379024           0.37855928620    
  8      2.4701911802           0.29692134655    
P   2
  1     82.120288349           -0.39420318847E-01      
  2      4.9523532869           0.64048403090    
P   1
  1      1.0828262029           1.0000000        
P   1
  1      0.49271277356          1.0000000        
P   1
  1      0.20483450942          1.0000000        
P   1
  1      0.80743615716E-01            1.0000000        
P   1
  1      0.25661157833E-01            1.0000000        
D   1
  1      4.1590000000           1.0000000        
D   1
  1      1.0190000000           1.0000000        
D   1
  1      0.46400000000          1.0000000        
D   1
  1      0.19400000000          1.0000000        
D   1
  1      0.67889829366E-01            1.0000000        
F   1
  1      0.33500000000          1.0000000        
F   1
  1      0.86900000000          1.0000000        
G   1
  1      0.68300000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Cl
data:
CHLORINE
S   10
  1 1467459.0095000             0.11478257194E-04      
  2 219756.1643300              0.89234299775E-04      
  3  50010.7703010              0.46911086186E-03      
  4  14164.8239180              0.19762446133E-02      
  5   4620.7465525              0.71419937783E-02      
  6   1667.8991635              0.22753219445E-01      
  7    650.29199265             0.63959782953E-01      
  8    269.38037376             0.15331059238    
  9    117.06752106             0.28986952417    
 10     52.811766843            0.36348071452    
S   3
  1    461.42769988             0.18019457578E-01      
  2    142.12665355             0.16489442314    
  3     54.437838768            0.63891587584    
S   1
  1     24.160770219            1.0000000        
S   1
  1      9.7083540306           1.0000000        
S   1
  1      4.5640696733           1.0000000        
S   1
  1      2.1194744832           1.0000000        
S   1
  1      0.75722365394          1.0000000        
S   1
  1      0.33747224597          1.0000000        
S   1
  1      0.13860775149          1.0000000        
S   1
  1      0.54234565513E-01            1.0000000        
P   8
  1   2501.9457890              0.24242618410E-03      
  2    592.88059285             0.21079961749E-02      
  3    192.18089186             0.11432693869E-01      
  4     72.875710488            0.44956698060E-01      
  5     30.436358370            0.13197476145    
  6     13.490178902            0.27493639225    
  7      6.1478071413           0.38347236372    
  8      2.8450944820           0.28871943885    
P   2
  1    105.39397936            -0.34311760144E-01      
  2      6.7369738513           0.64060818902    
P   1
  1      1.2421095772           1.0000000        
P   1
  1      0.55669714254          1.0000000        
P   1
  1      0.23387801464          1.0000000        
P   1
  1      0.93164490890E-01            1.0000000        
P   1
  1      0.27256146018E-01            1.0000000        
D   1
  1      5.1910000000           1.0000000        
D   1
  1      1.2760000000           1.0000000        
D   1
  1      0.58300000000          1.0000000        
D   1
  1      0.24300000000          1.0000000        
D   1
  1      0.83456538402E-01            1.0000000        
F   1
  1      0.42300000000          1.0000000        
F   1
  1      1.0890000000           1.0000000        
G   1
  1      0.82700000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ar
data:
ARGON
S   10
  1 1673421.9494000             0.11245990413E-04      
  2 250601.7537300              0.87428115798E-04      
  3  57030.9121200              0.45961641275E-03      
  4  16153.3039150              0.19363890742E-02      
  5   5269.4109288              0.69994046497E-02      
  6   1902.0315541              0.22312068196E-01      
  7    741.57677159             0.62808077697E-01      
  8    307.20901906             0.15101140997    
  9    133.52786203             0.28713661177    
 10     60.253381291            0.36385490107    
S   3
  1    522.02426206             0.18071323116E-01      
  2    161.51290469             0.16449219884    
  3     62.126369433            0.63897334899    
S   1
  1     27.590930012            1.0000000        
S   1
  1     11.175528881            1.0000000        
S   1
  1      5.2959065137           1.0000000        
S   1
  1      2.4782798895           1.0000000        
S   1
  1      0.91262095059          1.0000000        
S   1
  1      0.40426067549          1.0000000        
S   1
  1      0.16562886306          1.0000000        
S   1
  1      0.65129364729E-01            1.0000000        
P   8
  1   2868.4504581              0.24010435121E-03      
  2    679.71869590             0.20904788665E-02      
  3    220.36758824             0.11369316839E-01      
  4     83.620439734            0.44901977398E-01      
  5     34.964322657            0.13237156770    
  6     15.525131784            0.27709277600    
  7      7.0992979806           0.38613979646    
  8      3.3021336602           0.28492925372    
P   2
  1    128.78765667            -0.30509457751E-01      
  2      8.4357867977           0.64101621070    
P   1
  1      1.4618661855           1.0000000        
P   1
  1      0.64658010096          1.0000000        
P   1
  1      0.27229295755          1.0000000        
P   1
  1      0.10905182449          1.0000000        
P   1
  1      0.30101149684E-01            1.0000000        
D   1
  1      6.3150000000           1.0000000        
D   1
  1      1.5620000000           1.0000000        
D   1
  1      0.71500000000          1.0000000        
D   1
  1      0.29700000000          1.0000000        
D   1
  1      0.10105028218          1.0000000        
F   1
  1      0.54300000000          1.0000000        
F   1
  1      1.3250000000           1.0000000        
G   1
  1      1.0070000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: K
data:
POTASSIUM
S   11
  1 2022075.1391000             0.10144874011E-04      
  2 303044.6556800              0.78783500963E-04      
  3  69013.9384900              0.41380919674E-03      
  4  19559.2446150              0.17427571893E-02      
  5   6383.8934901              0.63004086126E-02      
  6   2305.3502858              0.20125347032E-01      
  7    899.14418101             0.56966060520E-01      
  8    372.59500133             0.13882654093    
  9    161.97635247             0.27132285414    
 10     73.085553853            0.36383620662    
 11     33.595644762            0.24724464776    
S   4
  1    685.49855365             0.44367463797E-02      
  2    211.66163373             0.42502718169E-01      
  3     80.851405131            0.18467742018    
  4     35.108667236            0.29353173891    
S   1
  1     14.409437283            1.0000000        
S   1
  1      6.8697147262           1.0000000        
S   1
  1      3.2121883687           1.0000000        
S   1
  1      1.2610484365           1.0000000        
S   1
  1      0.61438946301          1.0000000        
S   1
  1      0.27264370973          1.0000000        
S   1
  1      0.77173005207E-01            1.0000000        
S   1
  1      0.40918397569E-01            1.0000000        
S   1
  1      0.17055762425E-01            1.0000000        
P   9
  1   3469.6649718              0.21340225970E-03      
  2    822.02356107             0.18637844836E-02      
  3    266.58406636             0.10211431546E-01      
  4    101.28048161             0.40799604728E-01      
  5     42.429490761            0.12257473393    
  6     18.912083912            0.26405833679    
  7      8.7017779030           0.38227164575    
  8      4.0854567599           0.29998812383    
  9      1.8667286060           0.78007265591E-01      
P   5
  1     27.544639057           -0.58222994163E-02      
  2      9.2098893609          -0.26787531329E-01      
  3      1.7232877425           0.30666847665    
  4      0.77969303735          0.66927944165    
  5      0.34379047862          0.60376468615    
P   1
  1      0.14346681918          1.0000000        
P   1
  1      0.68000000000E-01            1.0000000        
P   1
  1      0.32000000000E-01            1.0000000        
P   1
  1      0.15300000000E-01            1.0000000        
D   1
  1      1.7000000000           1.0000000        
D   1
  1      0.51000000000          1.0000000        
D   1
  1      0.18000000000          1.0000000        
D   1
  1      0.54000000000E-01            1.0000000        
F   1
  1      0.26700000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ca
data:
CALCIUM
S   11
  1 2433075.4304000             0.91625196182E-05      
  2 364160.4301500              0.71271617974E-04      
  3  82898.7476370              0.37433706369E-03      
  4  23499.7305400              0.15762862250E-02      
  5   7671.2245985              0.57026102580E-02      
  6   2770.2330687              0.18255738108E-01      
  7   1080.6807550              0.51906421035E-01      
  8    448.04894531             0.12791238579    
  9    194.92007727             0.25586635231    
 10     88.039793338            0.36028678275    
 11     40.645696719            0.26838462020    
S   4
  1    779.53331918            -0.18403005509E-01      
  2    241.18856300            -0.17649440544    
  3     92.403869324           -0.77662799584    
  4     39.786090342           -1.3352155444     
S   1
  1     18.195864278            1.0000000        
S   1
  1      8.3321457067           1.0000000        
S   1
  1      3.9190196209           1.0000000        
S   1
  1      1.6667099493           1.0000000        
S   1
  1      0.80891084908          1.0000000        
S   1
  1      0.36174199934          1.0000000        
S   1
  1      0.82379874526E-01            1.0000000        
S   1
  1      0.47947864375E-01            1.0000000        
S   1
  1      0.22308112408E-01            1.0000000        
P   9
  1   4064.2232796              0.19780891021E-03      
  2    962.91550624             0.17307465902E-02      
  3    312.34501046             0.95298721105E-02      
  4    118.76056036             0.38387459783E-01      
  5     49.816153133            0.11679256218    
  6     22.259679401            0.25637225097    
  7     10.286094124            0.37986193747    
  8      4.8606982416           0.30805760637    
  9      2.2525682942           0.85755999942E-01      
P   5
  1     31.467555443           -0.42441487483E-02      
  2     10.657589056           -0.19579425947E-01      
  3      2.0505555426           0.21237507422    
  4      0.94362089228          0.46277871121    
  5      0.42709067504          0.39177495728    
P   1
  1      0.17788187209          1.0000000        
P   1
  1      0.86000000000E-01            1.0000000        
P   1
  1      0.41500000000E-01            1.0000000        
P   1
  1      0.20000000000E-01            1.0000000        
D   3
  1     16.924012098            0.35543971560E-01      
  2      4.4655403330           0.18133698335    
  3      1.4347576200           0.48002060116    
D   1
  1      0.46552376784          1.0000000        
D   1
  1      0.14097711082          1.0000000        
D   1
  1      0.41467009281E-01            1.0000000        
F   1
  1      0.32100000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Sc
data:
SCANDIUM
S   11
  1 2855231.1264000             0.84862794535E-05      
  2 427433.3422100              0.65998092974E-04      
  3  97233.2185450              0.34740968058E-03      
  4  27496.2228460              0.14694099525E-02      
  5   8948.7324409              0.53410667286E-02      
  6   3221.0397292              0.17200652511E-01      
  7   1252.0534077              0.49287065332E-01      
  8    517.26093376             0.12273534550    
  9    224.33127242             0.24910183844    
 10    101.10551671             0.35884366997    
 11     46.684957855            0.27782811319    
S   4
  1    947.75965484             0.36123019249E-02      
  2    293.07262846             0.35616224567E-01      
  3    111.70230657             0.16664064248    
  4     47.756215212            0.32531051399    
S   1
  1     21.121984009            1.0000000        
S   1
  1      9.7765922198           1.0000000        
S   1
  1      4.5982699340           1.0000000        
S   1
  1      1.9928487767           1.0000000        
S   1
  1      0.95939954457          1.0000000        
S   1
  1      0.42566790070          1.0000000        
S   1
  1      0.98132196006E-01            1.0000000        
S   1
  1      0.56894222237E-01            1.0000000        
S   1
  1      0.25369907195E-01            1.0000000        
P   9
  1   4611.4680242              0.19180655992E-03      
  2   1092.4666458              0.16801897753E-02      
  3    354.41923265             0.92763338425E-02      
  4    134.83390286             0.37537202735E-01      
  5     56.610873926            0.11493045217    
  6     25.336605518            0.25446811084    
  7     11.741313238            0.37993352765    
  8      5.5697268625           0.30948776388    
  9      2.5949954062           0.86972259257E-01      
P   5
  1     35.951198081           -0.55780446917E-02      
  2     12.301020232           -0.25933825208E-01      
  3      2.3876557755           0.27489094204    
  4      1.1031823600           0.59208047142    
  5      0.50008479496          0.49113471853    
P   1
  1      0.20796508799          1.0000000        
P   1
  1      0.10100000000          1.0000000        
P   1
  1      0.48000000000E-01            1.0000000        
P   1
  1      0.23000000000E-01            1.0000000        
D   5
  1     73.531179748            0.22506354976E-02      
  2     21.764759639            0.16377610133E-01      
  3      7.9233701690           0.63330446952E-01      
  4      3.1847889778           0.17056208548    
  5      1.3427790019           0.30119020299    
D   1
  1      0.56149574983          1.0000000        
D   1
  1      0.22764073650          1.0000000        
D   1
  1      0.85211221793E-01            1.0000000        
D   1
  1      0.35000000000E-01            1.0000000        
F   1
  1      1.4810000000           1.0000000        
F   1
  1      0.34500000000          1.0000000        
F   1
  1      0.11000000000          1.0000000        
G   1
  1      0.24700000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ti
data:
TITANIUM
S   11
  1 3070548.8651000             0.86954016630E-05      
  2 460777.8864300              0.67452737727E-04      
  3 104901.2288900              0.35477293028E-03      
  4  29695.8611990              0.14977525588E-02      
  5   9678.8892688              0.54309912055E-02      
  6   3490.1877912              0.17439360524E-01      
  7   1359.2217621              0.49835634640E-01      
  8    562.42721208             0.12379633943    
  9    244.22296250             0.25057490943    
 10    110.16668710             0.35934609007    
 11     50.881903357            0.27594242664    
S   4
  1    965.95430789             0.41773927781E-02      
  2    299.27072059             0.40277148567E-01      
  3    114.83772939             0.17898686817    
  4     49.477578954            0.31783043543    
S   1
  1     22.982839977            1.0000000        
S   1
  1     10.518305037            1.0000000        
S   1
  1      4.9774390567           1.0000000        
S   1
  1      2.1339846838           1.0000000        
S   1
  1      1.0342457284           1.0000000        
S   1
  1      0.46199774995          1.0000000        
S   1
  1      0.10621264194          1.0000000        
S   1
  1      0.54340347374E-01            1.0000000        
S   1
  1      0.25110217385E-01            1.0000000        
P   9
  1   5169.6755427              0.18802523596E-03      
  2   1225.0961638              0.16473458826E-02      
  3    397.60051934             0.91104554321E-02      
  4    151.36154684             0.36987450926E-01      
  5     63.613321773            0.11376329624    
  6     28.514560307            0.25345208574    
  7     13.248003298            0.38019402704    
  8      6.3048807760           0.30989136346    
  9      2.9493525821           0.87418944007E-01      
P   5
  1     40.738772213           -0.73233793267E-02      
  2     14.062358461           -0.34282591082E-01      
  3      2.7460680961           0.35655009250    
  4      1.2713688141           0.76112035427    
  5      0.57610015545          0.62716743237    
P   1
  1      0.23981820724          1.0000000        
P   1
  1      0.11000000000          1.0000000        
P   1
  1      0.50000000000E-01            1.0000000        
P   1
  1      0.23000000000E-01            1.0000000        
D   5
  1     89.589880075            0.21223030030E-02      
  2     26.591412960            0.15911819913E-01      
  3      9.7739715702           0.62875243121E-01      
  4      3.9625083655           0.17144170807    
  5      1.6890532654           0.30565506624    
D   1
  1      0.71539771469          1.0000000        
D   1
  1      0.29366677748          1.0000000        
D   1
  1      0.11079094851          1.0000000        
D   1
  1      0.45000000000E-01            1.0000000        
F   1
  1      2.0930000000           1.0000000        
F   1
  1      0.56200000000          1.0000000        
F   1
  1      0.19100000000          1.0000000        
G   1
  1      0.63400000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: V
data:
VANADIUM
S   11
  1 3360380.0382000             0.87027840678E-05      
  2 502646.7317800              0.67786024965E-04      
  3 114247.2286700              0.35699229090E-03      
  4  32321.9726300              0.15075507352E-02      
  5  10532.9472710              0.54664377528E-02      
  6   3798.3004439              0.17547310839E-01      
  7   1479.6094715              0.50106594778E-01      
  8    612.57405507             0.12431296066    
  9    266.22103326             0.25117026883    
 10    120.21980126             0.35926015903    
 11     55.591180848            0.27505075685    
S   4
  1   1082.4768635              0.39326847695E-02      
  2    334.94462061             0.38298477998E-01      
  3    128.31559026             0.17259908827    
  4     55.311589616            0.31287423870    
S   1
  1     25.108383036            1.0000000        
S   1
  1     11.667553242            1.0000000        
S   1
  1      5.5372073270           1.0000000        
S   1
  1      2.3781007618           1.0000000        
S   1
  1      1.1506947329           1.0000000        
S   1
  1      0.51283991040          1.0000000        
S   1
  1      0.11625711449          1.0000000        
S   1
  1      0.58272785598E-01            1.0000000        
S   1
  1      0.26662312245E-01            1.0000000        
P   9
  1   5782.8035005              0.18344743045E-03      
  2   1369.9392282              0.16095217453E-02      
  3    444.53147129             0.89242268749E-02      
  4    169.25617556             0.36375182379E-01      
  5     71.168730031            0.11246803294    
  6     31.933358374            0.25226107794    
  7     14.865336779            0.38039695005    
  8      7.0921740091           0.31068797325    
  9      3.3281157846           0.88141200458E-01      
P   5
  1     45.842906017           -0.56661391945E-02      
  2     15.940339016           -0.26718979445E-01      
  3      3.1257155025           0.27354632707    
  4      1.4485867558           0.57972883053    
  5      0.65577902825          0.47601110515    
P   1
  1      0.27311626644          1.0000000        
P   1
  1      0.12200000000          1.0000000        
P   1
  1      0.55000000000E-01            1.0000000        
P   1
  1      0.25000000000E-01            1.0000000        
D   5
  1    103.95047414             0.21007158819E-02      
  2     30.901688665            0.16015244877E-01      
  3     11.420321145            0.64127456940E-01      
  4      4.6573272292           0.17488905695    
  5      1.9963682623           0.31003778048    
D   1
  1      0.84967249531          1.0000000        
D   1
  1      0.34953221876          1.0000000        
D   1
  1      0.13165588233          1.0000000        
D   1
  1      0.52000000000E-01            1.0000000        
F   1
  1      2.9330000000           1.0000000        
F   1
  1      0.83100000000          1.0000000        
F   1
  1      0.25700000000          1.0000000        
G   1
  1      1.0090000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Cr
data:
CHROMIUM
S   11
  1 3637838.6820000             0.87693297699E-05      
  2 544864.4610000              0.68169050223E-04      
  3 123997.5507900              0.35844590272E-03      
  4  35116.7331660              0.15117006948E-02      
  5  11455.7022980              0.54731929774E-02      
  6   4135.9906712              0.17539430107E-01      
  7   1613.2513581              0.50004870927E-01      
  8    668.77932380             0.12393518958    
  9    291.01365155             0.25039606407    
 10    131.57328167             0.35870470429    
 11     60.924567928            0.27581148880    
S   4
  1   1196.2899601              0.77368642037E-02      
  2    369.76947592             0.75837835399E-01      
  3    141.54426084             0.34435148637    
  4     60.999228765            0.63249297923    
S   1
  1     27.599113358            1.0000000        
S   1
  1     12.882112056            1.0000000        
S   1
  1      6.1247513721           1.0000000        
S   1
  1      2.6332895309           1.0000000        
S   1
  1      1.2708482289           1.0000000        
S   1
  1      0.56483575923          1.0000000        
S   1
  1      0.12596808943          1.0000000        
S   1
  1      0.62045607277E-01            1.0000000        
S   1
  1      0.28144312720E-01            1.0000000        
P   9
  1   6395.8781792              0.18104788151E-03      
  2   1515.1701574              0.15893658935E-02      
  3    491.70538681             0.88258739429E-02      
  4    187.28416675             0.36068946983E-01      
  5     78.800346444            0.11189649648    
  6     35.396291693            0.25202239843    
  7     16.509278879            0.38082266430    
  8      7.8947396863           0.31035222437    
  9      3.7136414465           0.87980310362E-01      
P   5
  1     51.259312534           -0.60542038165E-02      
  2     17.934932523           -0.28761764001E-01      
  3      3.5257174218           0.29087768170    
  4      1.6339163906           0.61267525056    
  5      0.73852413834          0.50126035018    
P   1
  1      0.30752368193          1.0000000        
P   1
  1      0.13500000000          1.0000000        
P   1
  1      0.59000000000E-01            1.0000000        
P   1
  1      0.26000000000E-01            1.0000000        
D   5
  1    118.24986288             0.21012757435E-02      
  2     35.193935700            0.16212269500E-01      
  3     13.057816022            0.65581852668E-01      
  4      5.3485602844           0.17849601449    
  5      2.3004233713           0.31376763016    
D   1
  1      0.98114328305          1.0000000        
D   1
  1      0.40334183206          1.0000000        
D   1
  1      0.15135589551          1.0000000        
D   1
  1      0.60000000000E-01            1.0000000        
F   1
  1      3.7330000000           1.0000000        
F   1
  1      1.1470000000           1.0000000        
F   1
  1      0.36600000000          1.0000000        
G   1
  1      1.3820000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Mn
data:
MANGANESE
S   11
  1 4289357.6441000             0.79360554972E-05      
  2 636361.0028500              0.62542986761E-04      
  3 143637.2756900              0.33226388724E-03      
  4  40406.3454320              0.14130009568E-02      
  5  13104.3634170              0.51560918319E-02      
  6   4705.0664255              0.16659574919E-01      
  7   1825.7125432              0.47908083403E-01      
  8    753.33816229             0.11994903752    
  9    326.47253285             0.24550296959    
 10    147.10300670             0.35822739571    
 11     67.987226869            0.28295764442    
S   4
  1   1300.7266717              0.76025154141E-02      
  2    402.72027544             0.74365109808E-01      
  3    154.38971348             0.33780474819    
  4     66.443384613            0.62779331746    
S   1
  1     30.975316006            1.0000000        
S   1
  1     14.222980890            1.0000000        
S   1
  1      6.7598265074           1.0000000        
S   1
  1      2.9087083287           1.0000000        
S   1
  1      1.3966507792           1.0000000        
S   1
  1      0.61792624091          1.0000000        
S   1
  1      0.13439483715          1.0000000        
S   1
  1      0.65195053803E-01            1.0000000        
S   1
  1      0.29415713624E-01            1.0000000        
P   9
  1   6483.2629658              0.20479778890E-03      
  2   1556.7134859              0.17525750185E-02      
  3    509.73925460             0.95798802458E-02      
  4    195.28408089             0.38681362983E-01      
  5     82.542547525            0.11832401588    
  6     37.212076731            0.26168459627    
  7     17.425804462            0.38400628821    
  8      8.3691376962           0.29704166759    
  9      3.9409000444           0.78263290323E-01      
P   5
  1     57.202741010           -0.47749099800E-02      
  2     20.090935947           -0.22989729915E-01      
  3      3.9357553763           0.23197065881    
  4      1.8181984012           0.48435204043    
  5      0.81881535281          0.39159479004    
P   1
  1      0.34038359193          1.0000000        
P   1
  1      0.15000000000          1.0000000        
P   1
  1      0.63000000000E-01            1.0000000        
P   1
  1      0.27000000000E-01            1.0000000        
D   6
  1    200.40254535             0.89549560240E-03      
  2     59.898225773            0.76257630942E-02      
  3     22.810570167            0.34523224226E-01      
  4      9.5874142097           0.10552676975    
  5      4.2933710910           0.22575377683    
  6      1.9537618373           0.32766533667    
D   1
  1      0.87378873598          1.0000000        
D   1
  1      0.37597748904          1.0000000        
D   1
  1      0.14811547592          1.0000000        
D   1
  1      0.60000000000E-01            1.0000000        
G   1
  1      1.7550000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Fe
data:
IRON
S   11
  1 4313154.4338000             0.86712290122E-05      
  2 645875.0825300              0.67423150519E-04      
  3 146981.8769800              0.35448747955E-03      
  4  41630.6150440              0.14948285557E-02      
  5  13580.6201090              0.54136698440E-02      
  6   4902.0620613              0.17362460824E-01      
  7   1911.2900837              0.49566574059E-01      
  8    791.99837852             0.12309089705    
  9    344.54799181             0.24936705764    
 10    155.78722730             0.35858414677    
 11     72.179380315            0.27738221642    
S   4
  1   1417.9125091              0.74871631942E-02      
  2    439.23184195             0.73337584435E-01      
  3    168.51006820             0.33383143870    
  4     72.776269412            0.62022524641    
S   1
  1     32.752961774            1.0000000        
S   1
  1     15.434336101            1.0000000        
S   1
  1      7.3639318205           1.0000000        
S   1
  1      3.1698832880           1.0000000        
S   1
  1      1.5243708395           1.0000000        
S   1
  1      0.67496281152          1.0000000        
S   1
  1      0.14718566032          1.0000000        
S   1
  1      0.70082216629E-01            1.0000000        
S   1
  1      0.31208269419E-01            1.0000000        
P   9
  1   7709.0587627              0.17711229843E-03      
  2   1826.4666323              0.15560056795E-02      
  3    592.84368362             0.86629536960E-02      
  4    225.93763245             0.35565954156E-01      
  5     95.164758890            0.11098847278    
  6     42.823132375            0.25177796624    
  7     20.036286581            0.38166911079    
  8      9.6159346283           0.30963598261    
  9      4.5393538787           0.87558276626E-01      
P   5
  1     62.997519003           -0.50910388724E-02      
  2     22.262748731           -0.24540463235E-01      
  3      4.3900064942           0.24345605487    
  4      2.0328913928           0.50781898425    
  5      0.91592621576          0.41214895672    
P   1
  1      0.38036653507          1.0000000        
P   1
  1      0.16000000000          1.0000000        
P   1
  1      0.67000000000E-01            1.0000000        
P   1
  1      0.28000000000E-01            1.0000000        
D   6
  1    218.33430163             0.93700006628E-03      
  2     65.256292616            0.80008769378E-02      
  3     24.866944817            0.36305286587E-01      
  4     10.473399301            0.11057189871    
  5      4.6947005007           0.23219588596    
  6      2.1315982534           0.32922859685    
D   1
  1      0.94748004605          1.0000000        
D   1
  1      0.40346488831          1.0000000        
D   1
  1      0.15687414728          1.0000000        
D   1
  1      0.62000000000E-01            1.0000000        
F   1
  1      5.1030000000           1.0000000        
F   1
  1      1.5980000000           1.0000000        
F   1
  1      0.50500000000          1.0000000        
G   1
  1      2.1280000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Co
data:
COBALT
S   11
  1 4658206.5032000             0.86609506454E-05      
  2 697560.8745300              0.67336300186E-04      
  3 158759.8712400              0.35399044899E-03      
  4  44969.0993790              0.14926384309E-02      
  5  14670.7142470              0.54053095095E-02      
  6   5295.8947250              0.17335233605E-01      
  7   2065.0581167              0.49486641301E-01      
  8    855.90627750             0.12289351961    
  9    372.48747255             0.24903230028    
 10    168.50576608             0.35838320259    
 11     78.128761566            0.27777974150    
S   4
  1   1534.5149885              0.74464372833E-02      
  2    475.52976096             0.72993601986E-01      
  3    182.54836839             0.33243104986    
  4     78.916467177            0.61900490005    
S   1
  1     35.500865522            1.0000000        
S   1
  1     16.790414486            1.0000000        
S   1
  1      8.0240232510           1.0000000        
S   1
  1      3.4571682964           1.0000000        
S   1
  1      1.6599835391           1.0000000        
S   1
  1      0.73380022453          1.0000000        
S   1
  1      0.15878613103          1.0000000        
S   1
  1      0.74535659476E-01            1.0000000        
S   1
  1      0.32867351695E-01            1.0000000        
P   9
  1   8425.4331352              0.17491775490E-03      
  2   1995.8758452              0.15378901702E-02      
  3    647.76765681             0.85752453448E-02      
  4    246.88261214             0.35295266911E-01      
  5    104.00952246             0.11050007672    
  6     46.827478138            0.25160924538    
  7     21.934444535            0.38209003019    
  8     10.540499528            0.30947119879    
  9      4.9820419385           0.87436873012E-01      
P   5
  1     69.270787130           -0.61172424428E-02      
  2     24.583977935           -0.29655043898E-01      
  3      4.8562258878           0.29163333190    
  4      2.2480916102           0.60629408335    
  5      1.0114285977           0.49057440018    
P   1
  1      0.41919905455          1.0000000        
P   1
  1      0.17500000000          1.0000000        
P   1
  1      0.73000000000E-01            1.0000000        
P   1
  1      0.30000000000E-01            1.0000000        
D   6
  1    237.58450966             0.97593282671E-03      
  2     71.086896302            0.83432571945E-02      
  3     27.119080683            0.37958471100E-01      
  4     11.448239054            0.11522936171    
  5      5.1391806672           0.23843467913    
  6      2.3323492099           0.33205699955    
D   1
  1      1.0338662062           1.0000000        
D   1
  1      0.43785146294          1.0000000        
D   1
  1      0.16895004948          1.0000000        
D   1
  1      0.66000000000E-01            1.0000000        
F   1
  1      5.9750000000           1.0000000        
F   1
  1      1.9030000000           1.0000000        
F   1
  1      0.59400000000          1.0000000        
G   1
  1      2.5000000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ni
data:
NICKEL
S   11
  1 5037649.9532000             0.86072778771E-05      
  2 754246.3941800              0.66935354750E-04      
  3 171644.1601000              0.35190801168E-03      
  4  48617.2302860              0.14839082715E-02      
  5  15860.9617950              0.53736344264E-02      
  6   5726.0018653              0.17233376287E-01      
  7   2232.9547317              0.49211476915E-01      
  8    925.49649101             0.12232504536    
  9    402.75336913             0.24829251588    
 10    182.19422856             0.35825476194    
 11     84.494109788            0.27881865553    
S   4
  1   1678.0564586              0.82462870895E-02      
  2    519.21358326             0.81505940361E-01      
  3    198.95881607             0.37495727651    
  4     85.901180703            0.70841743832    
S   1
  1     38.435760123            1.0000000        
S   1
  1     18.252349351            1.0000000        
S   1
  1      8.7283616939           1.0000000        
S   1
  1      3.7616245662           1.0000000        
S   1
  1      1.8028217338           1.0000000        
S   1
  1      0.79507140513          1.0000000        
S   1
  1      0.17031720284          1.0000000        
S   1
  1      0.78971236177E-01            1.0000000        
S   1
  1      0.34503486750E-01            1.0000000        
P   9
  1   9156.5701453              0.17346418360E-03      
  2   2169.0239526              0.15257220493E-02      
  3    703.98918991             0.85163281036E-02      
  4    268.36293215             0.35117466952E-01      
  5    113.10288796             0.11020275383    
  6     50.955539222            0.25162601670    
  7     23.896708209            0.38246389853    
  8     11.498241522            0.30907230267    
  9      5.4410908056           0.87194377415E-01      
P   5
  1     75.938560736           -0.74635546629E-02      
  2     27.037350184           -0.36453401627E-01      
  3      5.3404687432           0.35633549406    
  4      2.4700181361           0.73774121992    
  5      1.1095029064           0.59439383024    
P   1
  1      0.45899767101          1.0000000        
P   1
  1      0.18700000000          1.0000000        
P   1
  1      0.76200000000E-01            1.0000000        
P   1
  1      0.31000000000E-01            1.0000000        
D   6
  1    258.11131142             0.23726274275E-02      
  2     77.254891371            0.20330132784E-01      
  3     29.500240033            0.92748486665E-01      
  4     12.477446945            0.28082284560    
  5      5.6070455111           0.57392657880    
  6      2.5427744163           0.78766058527    
D   1
  1      1.1238296774           1.0000000        
D   1
  1      0.47361171459          1.0000000        
D   1
  1      0.18161858319          1.0000000        
D   1
  1      0.71000000000E-01            1.0000000        
F   1
  1      6.7580000000           1.0000000        
F   1
  1      2.1740000000           1.0000000        
F   1
  1      0.68100000000          1.0000000        
G   1
  1      2.8720000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Cu
data:
COPPER
S   11
  1 5056467.8898000             0.93501916365E-05      
  2 759457.8383500              0.72323443222E-04      
  3 173524.8849700              0.37813833845E-03      
  4  49327.2599880              0.15870129862E-02      
  5  16144.1499300              0.57220685294E-02      
  6   5844.5964680              0.18268390048E-01      
  7   2284.6812739              0.51893720863E-01      
  8    948.88232514             0.12796192366    
  9    413.66215455             0.25629891036    
 10    187.38942059             0.36064416138    
 11     86.872771648            0.26833664660    
S   4
  1   1744.0598287              0.88587079141E-02      
  2    540.93295513             0.86522785813E-01      
  3    207.99736224             0.38932285258    
  4     90.475793036            0.69777199902    
S   1
  1     38.869687699            1.0000000        
S   1
  1     18.974829147            1.0000000        
S   1
  1      9.0953644635           1.0000000        
S   1
  1      3.8330020174           1.0000000        
S   1
  1      1.8198891499           1.0000000        
S   1
  1      0.79068098393          1.0000000        
S   1
  1      0.14914142106          1.0000000        
S   1
  1      0.72448090592E-01            1.0000000        
S   1
  1      0.30959925368E-01            1.0000000        
P   9
  1   9720.4614555              0.17828803512E-03      
  2   2302.7557452              0.15678108633E-02      
  3    747.48498314             0.87470094509E-02      
  4    285.00132623             0.36044549301E-01      
  5    120.15121609             0.11287209053    
  6     54.145261156            0.25647377341    
  7     25.406033563            0.38512918379    
  8     12.224331465            0.30316512356    
  9      5.7638720668           0.81677218969E-01      
P   5
  1     83.210837217           -0.63530359993E-02      
  2     29.694779129           -0.31383834666E-01      
  3      5.8248516206           0.30930039753    
  4      2.6746181180           0.63583925938    
  5      1.1841836775           0.50946045967    
P   1
  1      0.48043583535          1.0000000        
P   1
  1      0.18700000000          1.0000000        
P   1
  1      0.76200000000E-01            1.0000000        
P   1
  1      0.31000000000E-01            1.0000000        
D   6
  1    249.54025080             0.12432881244E-02      
  2     74.683914534            0.10456901995E-01      
  3     28.392717116            0.46451241249E-01      
  4     11.955968430            0.13541359729    
  5      5.3210744624           0.25852899978    
  6      2.3661189459           0.33168127635    
D   1
  1      1.0131863994           1.0000000        
D   1
  1      0.40710035940          1.0000000        
D   1
  1      0.14742541032          1.0000000        
D   1
  1      0.71000000000E-01            1.0000000        
F   1
  1      6.9620000000           1.0000000        
F   1
  1      2.2330000000           1.0000000        
F   1
  1      0.70400000000          1.0000000        
G   1
  1      3.2450000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Zn
data:
ZINC
S   11
  1 5742307.1507000             0.86864381562E-05      
  2 861450.7879000              0.67364668570E-04      
  3 196346.0586600              0.35349715135E-03      
  4  55682.8707370              0.14884153943E-02      
  5  18183.9023940              0.53840916617E-02      
  6   6569.6448019              0.17252738209E-01      
  7   2563.5613276              0.49238679132E-01      
  8   1063.1147176              0.12235812174    
  9    462.89771078             0.24835390245    
 10    209.52821049             0.35830632832    
 11     97.240787991            0.27880259960    
S   4
  1   1929.2689992              0.83077002177E-02      
  2    598.07122307             0.81882590163E-01      
  3    229.69667336             0.37588060221    
  4     99.416819228            0.71067260445    
S   1
  1     44.241101421            1.0000000        
S   1
  1     21.194367113            1.0000000        
S   1
  1     10.158731597            1.0000000        
S   1
  1      4.3746176158           1.0000000        
S   1
  1      2.0901489071           1.0000000        
S   1
  1      0.91869136437          1.0000000        
S   1
  1      0.19278660606          1.0000000        
S   1
  1      0.87329915171E-01            1.0000000        
S   1
  1      0.37552217126E-01            1.0000000        
P   9
  1  10690.4451070              0.17142867222E-03      
  2   2532.3159340              0.15088012830E-02      
  3    821.94295003             0.84368777910E-02      
  4    313.42757800             0.34898103208E-01      
  5    132.18314247             0.10993617353    
  6     59.620554387            0.25207277070    
  7     28.019488868            0.38325657524    
  8     13.511704850            0.30787091255    
  9      6.4053711253           0.86411696761E-01      
P   5
  1     89.981131918           -0.96262847843E-02      
  2     32.241767106           -0.47509407258E-01      
  3      6.3809448581           0.45834100431    
  4      2.9477928353           0.94473799128    
  5      1.3200854955           0.75923464871    
P   1
  1      0.54424674445          1.0000000        
P   1
  1      0.25799971797          1.0000000        
P   1
  1      0.92863192359E-01            1.0000000        
P   1
  1      0.34059341410E-01            1.0000000        
D   6
  1    305.22298937             0.27359792434E-02      
  2     91.468273202            0.23585229776E-01      
  3     34.986985968            0.10858422440    
  4     14.849415187            0.32843594226    
  5      6.6858545707           0.66180235634    
  6      3.0309412620           0.89165339320    
D   1
  1      1.3355050671           1.0000000        
D   1
  1      0.55883176392          1.0000000        
D   1
  1      0.21180799287          1.0000000        
D   1
  1      0.83000000000E-01            1.0000000        
F   1
  1      8.0200000000           1.0000000        
F   1
  1      2.6140000000           1.0000000        
F   1
  1      0.83600000000          1.0000000        
G   1
  1      3.6170000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ga
data:
GALLIUM
S   11
  1 6623802.0274000             0.79091326051E-05      
  2 987904.0707500              0.61835727406E-04      
  3 224132.0589900              0.32636322451E-03      
  4  63315.1929430              0.13810365049E-02      
  5  20611.3127020              0.50153772104E-02      
  6   7429.1672482              0.16130936803E-01      
  7   2894.2071720              0.46240827188E-01      
  8   1198.9915786              0.11579099571    
  9    521.82003812             0.23834840794    
 10    236.27549237             0.35374255971    
 11    109.98395671             0.29055721918    
S   4
  1   2101.2587253              0.83039611523E-02      
  2    650.97022519             0.82254127688E-01      
  3    250.22438356             0.38021717478    
  4    108.17616625             0.74503594690    
S   1
  1     51.057486710            1.0000000        
S   1
  1     23.647474527            1.0000000        
S   1
  1     11.361701144            1.0000000        
S   1
  1      5.0178135897           1.0000000        
S   1
  1      2.4102674998           1.0000000        
S   1
  1      1.0741046685           1.0000000        
S   1
  1      0.25745075831          1.0000000        
S   1
  1      0.12175227548          1.0000000        
S   1
  1      0.52360599017E-01            1.0000000        
S   1
  1      0.22760500759E-01            1.0000000        
P   9
  1  14711.7504830              0.11130990649E-03      
  2   3482.1451716              0.98495921142E-03      
  3   1130.2186655              0.55854182058E-02      
  4    431.54093448             0.23682413047E-01      
  5    182.41723648             0.78211587173E-01      
  6     82.706753603            0.19503829929    
  7     39.228128772            0.34131988495    
  8     19.201979939            0.35718665135    
  9      9.5056966689           0.16395955052    
P   2
  1     92.615613022           -0.85848284169E-01      
  2     33.750148165           -0.39435019538    
P   4
  1      7.3482283015           0.37941606569    
  2      3.7813384844           0.71306291866    
  3      2.3145183128           0.43210001481    
  4      0.80346859715          0.25838122797    
P   1
  1      1.5423710087           1.0000000        
P   1
  1      0.32910239639          1.0000000        
P   1
  1      0.11834088831          1.0000000        
P   1
  1      0.41627877699E-01            1.0000000        
D   7
  1    363.49565218             0.87402299276E-03      
  2    109.01749589             0.76751934098E-02      
  3     41.866430715            0.36388975341E-01      
  4     17.879279894            0.11325183017    
  5      8.1201893671           0.23770881294    
  6      3.7360611356           0.33306060389    
  7      1.6826812549           0.33130613756    
D   1
  1      0.72655790500          1.0000000        
D   1
  1      0.28498585079          1.0000000        
D   1
  1      0.11200000000          1.0000000        
D   1
  1      0.36117914269E-01            1.0000000        
F   1
  1      0.18100000000          1.0000000        
F   1
  1      0.47100000000          1.0000000        
G   1
  1      0.40320000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ge
data:
GERMANIUM
S   11
  1 7233056.0346000             0.76638751457E-05      
  2 1082886.1731000             0.59603601369E-04      
  3 246481.4695900              0.31319088031E-03      
  4  69862.4269550              0.13194051561E-02      
  5  22815.8096620              0.47736099191E-02      
  6   8246.5369297              0.15319250467E-01      
  7   3219.9367257              0.43900870673E-01      
  8   1336.5743706              0.11028573632    
  9    582.87737501             0.22912630489    
 10    264.59511360             0.34779259246    
 11    123.77823320             0.29968722223    
S   4
  1   2311.1055804              0.75033084731E-02      
  2    716.27089868             0.74778386626E-01      
  3    275.45330910             0.35092882302    
  4    118.93292565             0.72055989686    
S   1
  1     58.435699085            1.0000000        
S   1
  1     26.261575973            1.0000000        
S   1
  1     12.664880671            1.0000000        
S   1
  1      5.7269548505           1.0000000        
S   1
  1      2.7555023203           1.0000000        
S   1
  1      1.2432886754           1.0000000        
S   1
  1      0.33107183846          1.0000000        
S   1
  1      0.15964081368          1.0000000        
S   1
  1      0.68463178923E-01            1.0000000        
S   1
  1      0.31407880009E-01            1.0000000        
P   9
  1  16555.7110740              0.10199370391E-03      
  2   3914.9903745              0.90504190546E-03      
  3   1269.4766518              0.51558490762E-02      
  4    484.35437789             0.22010335708E-01      
  5    204.64985822             0.73434798827E-01      
  6     92.791032094            0.18608955294    
  7     44.055060255            0.33330981945    
  8     21.601319931            0.36229776246    
  9     10.732169233            0.17765186263    
P   2
  1    100.88933962            -0.11146182144    
  2     36.640254741           -0.52324324314    
P   4
  1      8.0343224115           0.31484763263    
  2      4.5613438333           0.38737744790    
  3      3.1794882223           0.50034353638    
  4      0.92612041457          0.22656707948    
P   1
  1      1.7977040907           1.0000000        
P   1
  1      0.41386865432          1.0000000        
P   1
  1      0.15830798709          1.0000000        
P   1
  1      0.57877035911E-01            1.0000000        
D   7
  1    420.99565921             0.78212192196E-03      
  2    126.36209818             0.69560123831E-02      
  3     48.661473548            0.33712188323E-01      
  4     20.880325527            0.10717291194    
  5      9.5418229355           0.23161030141    
  6      4.4353653868           0.33390954301    
  7      2.0285421942           0.33720676378    
D   1
  1      0.89484935267          1.0000000        
D   1
  1      0.35786074334          1.0000000        
D   1
  1      0.14000000000          1.0000000        
D   1
  1      0.48644812609E-01            1.0000000        
F   1
  1      0.54920000000          1.0000000        
F   1
  1      0.21900000000          1.0000000        
G   1
  1      0.46810000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: As
data:
ARSENIC
S   11
  1 8217482.6198000             0.70590618422E-05      
  2 1230500.3720000             0.54880889611E-04      
  3 280225.8664800              0.28809164698E-03      
  4  79482.5094150              0.12129779464E-02      
  5  25963.7833510              0.43914559880E-02      
  6   9381.4010193              0.14125362961E-01      
  7   3660.4911972              0.40657915618E-01      
  8   1518.2356024              0.10300382633    
  9    661.80098920             0.21730077101    
 10    300.58642127             0.33995751412    
 11    141.11137296             0.31088634077    
S   4
  1   2577.0870580              0.70752991980E-02      
  2    798.07872277             0.71383615256E-01      
  3    306.57574948             0.34287024634    
  4    132.27558802             0.74361403413    
S   1
  1     67.448702235            1.0000000        
S   1
  1     29.209180441            1.0000000        
S   1
  1     14.156509326            1.0000000        
S   1
  1      6.5561506682           1.0000000        
S   1
  1      3.1392847238           1.0000000        
S   1
  1      1.4294631050           1.0000000        
S   1
  1      0.41103390885          1.0000000        
S   1
  1      0.20032453310          1.0000000        
S   1
  1      0.85669928850E-01            1.0000000        
S   1
  1      0.38271633092E-01            1.0000000        
P   10
  1  25198.5042780              0.54758168372E-04      
  2   5972.5601381              0.48572462452E-03      
  3   1941.9123183              0.27908085625E-02      
  4    743.59381104             0.12201505962E-01      
  5    315.63828052             0.42666285138E-01      
  6    143.96878925             0.11870919141    
  7     69.068683164            0.24909407023    
  8     34.254305629            0.36061356903    
  9     17.371746759            0.29392241832    
 10      8.7634555628           0.97829057366E-01      
P   5
  1    228.49024582            -0.24900140765E-02      
  2     86.313555488           -0.19482515843E-01      
  3     36.751366267           -0.61495071038E-01      
  4      8.5365149464           0.47258065062    
  5      4.1935128599           1.0236065079     
P   1
  1      2.0464980417           1.0000000        
P   1
  1      0.98000000000          1.0000000        
P   1
  1      0.40534340618          1.0000000        
P   1
  1      0.16655070471          1.0000000        
P   1
  1      0.65981706123E-01            1.0000000        
D   7
  1    479.32599612             0.71722800196E-03      
  2    143.96064855             0.64419223046E-02      
  3     55.548909224            0.31776498964E-01      
  4     23.927581006            0.10276249168    
  5     10.988194172            0.22710952843    
  6      5.1489356262           0.33477474118    
  7      2.3836810892           0.34175986071    
D   1
  1      1.0688204667           1.0000000        
D   1
  1      0.43305693742          1.0000000        
D   1
  1      0.17000000000          1.0000000        
D   1
  1      0.60336766779E-01            1.0000000        
F   1
  1      0.26400000000          1.0000000        
F   1
  1      0.64400000000          1.0000000        
G   1
  1      0.54650000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Se
data:
SELENIUM
S   11
  1 9520446.7743000             0.63309690150E-05      
  2 1424984.0802000             0.49267697990E-04      
  3 324127.5768200              0.25920249744E-03      
  4  91774.8769500              0.10943145743E-02      
  5  29932.7257250              0.39706139067E-02      
  6  10804.6179050              0.12801187916E-01      
  7   4214.0134779              0.36980379417E-01      
  8   1747.8116633              0.94461349896E-01      
  9    762.12160878             0.20274705434    
 10    346.45604141             0.32878956424    
 11    163.11569304             0.32300252609    
S   4
  1   2614.5153067              0.79113928518E-02      
  2    818.68552756             0.77187739408E-01      
  3    318.63398991             0.35672061949    
  4    139.04844125             0.75846750004    
S   1
  1     78.348734788            1.0000000        
S   1
  1     31.704290663            1.0000000        
S   1
  1     15.505859269            1.0000000        
S   1
  1      7.3227423625           1.0000000        
S   1
  1      3.4969483549           1.0000000        
S   1
  1      1.6121546085           1.0000000        
S   1
  1      0.49587158541          1.0000000        
S   1
  1      0.24092138175          1.0000000        
S   1
  1      0.10231739397          1.0000000        
S   1
  1      0.40316301954E-01            1.0000000        
P   10
  1  25360.2156150              0.60531790911E-04      
  2   5993.7896610              0.53987774437E-03      
  3   1943.0741755              0.31130456170E-02      
  4    742.35316156             0.13599674694E-01      
  5    314.62114597             0.47298958377E-01      
  6    143.34748044             0.12981487726    
  7     68.673617552            0.26569982215    
  8     34.013554117            0.36723195311    
  9     17.198099621            0.27478356345    
 10      8.5830329629           0.79256169683E-01      
P   5
  1    236.58209146            -0.12271649354E-02      
  2     90.576183214           -0.92584627774E-02      
  3     39.086689301           -0.28428728384E-01      
  4      9.3084344018           0.21201102192    
  5      4.6169923084           0.47117589805    
P   1
  1      2.2653477506           1.0000000        
P   1
  1      1.0800000000           1.0000000        
P   1
  1      0.47939328581          1.0000000        
P   1
  1      0.19619983845          1.0000000        
P   1
  1      0.76256339275E-01            1.0000000        
P   1
  1      0.25031496127E-01            1.0000000        
D   7
  1    539.48700124             0.66722955533E-03      
  2    162.13394435             0.60399330928E-02      
  3     62.661795641            0.30238666507E-01      
  4     27.077272889            0.99267892065E-01      
  5     12.483003929            0.22358036310    
  6      5.8864623136           0.33574682762    
  7      2.7519131105           0.34554856483    
D   1
  1      1.2500769617           1.0000000        
D   1
  1      0.51172841843          1.0000000        
D   1
  1      0.20000000000          1.0000000        
D   1
  1      0.65822945067E-01            1.0000000        
F   1
  1      0.28400000000          1.0000000        
F   1
  1      0.70970000000          1.0000000        
G   1
  1      0.57300000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Br
data:
BROMINE
S   11
  1 10629044.2640000            0.59322104325E-05      
  2 1591918.2739000             0.46118980689E-04      
  3 362333.9843700              0.24244612378E-03      
  4 102643.1114100              0.10231422748E-02      
  5  33489.8466680              0.37121984175E-02      
  6  12091.2471900              0.11978107933E-01      
  7   4716.1908789              0.34682692842E-01      
  8   1956.1598080              0.89068331264E-01      
  9    853.08595848             0.19330124567    
 10    387.96633666             0.32071144956    
 11    182.85156613             0.32996797574    
S   4
  1   3240.4086421              0.65905194070E-02      
  2   1000.4631935              0.68439609656E-01      
  3    383.37301682             0.34495478668    
  4    166.03929698             0.82315542085    
S   1
  1     87.919906994            1.0000000        
S   1
  1     35.675840068            1.0000000        
S   1
  1     17.543657842            1.0000000        
S   1
  1      8.4473660433           1.0000000        
S   1
  1      3.9666180616           1.0000000        
S   1
  1      1.8356815987           1.0000000        
S   1
  1      0.59084778776          1.0000000        
S   1
  1      0.28863218421          1.0000000        
S   1
  1      0.12153380537          1.0000000        
S   1
  1      0.47973937210E-01            1.0000000        
P   10
  1  26566.4765790              0.62073657410E-04      
  2   6290.5088566              0.55131636217E-03      
  3   2043.3178410              0.31680110980E-02      
  4    781.67221007             0.13816597290E-01      
  5    331.51078945             0.48018539681E-01      
  6    151.09198667             0.13162015183    
  7     72.395278166            0.26860052203    
  8     35.869510844            0.36827391093    
  9     18.139906191            0.27108612944    
 10      9.0466688944           0.76215338633E-01      
P   5
  1    253.71822146            -0.13729169381E-02      
  2     97.250818058           -0.10393811185E-01      
  3     42.034897960           -0.32204214612E-01      
  4      9.9685673555           0.24224770086    
  5      4.9395854745           0.53557868398    
P   1
  1      2.4382845475           1.0000000        
P   1
  1      1.1800000000           1.0000000        
P   1
  1      0.51047564965          1.0000000        
P   1
  1      0.21215851928          1.0000000        
P   1
  1      0.83943604990E-01            1.0000000        
P   1
  1      0.24444628965E-01            1.0000000        
D   7
  1    601.44434484             0.62783723765E-03      
  2    180.85718640             0.57205157153E-02      
  3     69.986806340            0.29002521527E-01      
  4     30.324710300            0.96446989766E-01      
  5     14.027909238            0.22065825870    
  6      6.6511702082           0.33657642375    
  7      3.1354168338           0.34872040582    
D   1
  1      1.4393591843           1.0000000        
D   1
  1      0.59350441438          1.0000000        
D   1
  1      0.23000000000          1.0000000        
D   1
  1      0.76665512897E-01            1.0000000        
F   1
  1      0.34070000000          1.0000000        
F   1
  1      0.82570000000          1.0000000        
G   1
  1      0.64910000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Kr
data:
KRYPTON
S   11
  1 11713823.0080000            0.56915790360E-05      
  2 1755253.3979000             0.44214471278E-04      
  3 399717.4192400              0.23227813842E-03      
  4 113285.7926000              0.97973661050E-03      
  5  36977.2052930              0.35537627541E-02      
  6  13355.0365800              0.11468673282E-01      
  7   5210.9012988              0.33241627469E-01      
  8   2162.1137020              0.85620725674E-01      
  9    943.29291023             0.18708766876    
 10    429.20724331             0.31497583326    
 11    202.40720840             0.33406191042    
S   4
  1   3260.4985521              0.73091509287E-02      
  2   1011.1069716              0.74040355445E-01      
  3    392.44359273             0.35414962222    
  4    173.21702132             0.80188286115    
S   1
  1     96.619988467            1.0000000        
S   1
  1     38.158284867            1.0000000        
S   1
  1     18.959517570            1.0000000        
S   1
  1      9.2505996199           1.0000000        
S   1
  1      4.3486517621           1.0000000        
S   1
  1      2.0380324209           1.0000000        
S   1
  1      0.69110152540          1.0000000        
S   1
  1      0.33506065143          1.0000000        
S   1
  1      0.14074441124          1.0000000        
S   1
  1      0.56272458649E-01            1.0000000        
P   10
  1  28609.3357670              0.60526369543E-04      
  2   6773.1236364              0.53786288403E-03      
  3   2199.8011079              0.30935356550E-02      
  4    841.50201590             0.13514318412E-01      
  5    356.92110288             0.47090086910E-01      
  6    162.71174351             0.12960370449    
  7     78.004264994            0.26607435646    
  8     38.682579997            0.36775851233    
  9     19.589158685            0.27406903542    
 10      9.7990863417           0.78773352304E-01      
P   5
  1    261.37786869            -0.16397212361E-02      
  2    100.09932146            -0.12034797573E-01      
  3     44.012139363           -0.34891485263E-01      
  4     10.854010739            0.25212650561    
  5      5.4351930182           0.57400781830    
P   1
  1      2.7062805542           1.0000000        
P   1
  1      1.3195633408           1.0000000        
P   1
  1      0.58004455967          1.0000000        
P   1
  1      0.24329976264          1.0000000        
P   1
  1      0.96823725087E-01            1.0000000        
P   1
  1      0.26906848533E-01            1.0000000        
D   7
  1    665.35057386             0.59588702935E-03      
  2    200.17995366             0.54594260457E-02      
  3     77.545085570            0.27980992479E-01      
  4     33.677854345            0.94119165910E-01      
  5     15.624928334            0.21825215619    
  6      7.4427867423           0.33739971242    
  7      3.5336073535           0.35141418853    
D   1
  1      1.6363725142           1.0000000        
D   1
  1      0.67845684728          1.0000000        
D   1
  1      0.27000000000          1.0000000        
D   1
  1      0.90067366867E-01            1.0000000        
F   1
  1      0.41300000000          1.0000000        
F   1
  1      0.95570000000          1.0000000        
G   1
  1      0.73950000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Rb
data:
RUBIDIUM
S   2
  1      7.4744618040           0.26999390986    
  2      6.7296180594          -0.42624989529    
S   1
  1      2.7822883445           1.0000000        
S   1
  1      0.53494544647          1.0000000        
S   1
  1      0.22522959349          1.0000000        
S   1
  1      0.50765580412E-01            1.0000000        
S   1
  1      0.26940281781E-01            1.0000000        
S   1
  1      0.13051395489E-01            1.0000000        
P   4
  1      5.9998960731           0.54568549670E-01      
  2      3.2040784712          -0.26447792498    
  3      0.86991979950          0.50033505958    
  4      0.44104169728          0.75243449327    
P   1
  1      0.22139898232          1.0000000        
P   1
  1      0.10679039696          1.0000000        
P   1
  1      0.33292658822E-01            1.0000000        
P   1
  1      0.12847003750E-01            1.0000000        
D   2
  1      4.6530655240          -0.11653388661E-02      
  2      0.44914033653          0.15584297068    
D   1
  1      0.10089577190          1.0000000        
D   1
  1      0.27432280711E-01            1.0000000        
D   1
  1      0.95353625581E-02            1.0000000        
F   1
  1      0.85245000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Sr
data:
STRONTIUM
S   2
  1     11.000000000           -0.26157031021    
  2      9.9000000000           0.36446668395    
S   1
  1      2.8771178206           1.0000000        
S   1
  1      0.63364987829          1.0000000        
S   1
  1      0.28588739731          1.0000000        
S   1
  1      0.61938540840E-01            1.0000000        
S   1
  1      0.31237518881E-01            1.0000000        
S   1
  1      0.16266139051E-01            1.0000000        
P   4
  1      7.6233499793           0.71548409039E-01      
  2      3.6643075442          -0.44232262175    
  3      0.97809648234          0.55690782709    
  4      0.77815253363          0.63437348922    
P   1
  1      0.40666316828          1.0000000        
P   1
  1      0.18725455934          1.0000000        
P   1
  1      0.56304594427E-01            1.0000000        
P   1
  1      0.21826701680E-01            1.0000000        
D   2
  1      4.3003648126          -0.43567751655E-02      
  2      0.84876551534          0.13176477946    
D   1
  1      0.29200562252          1.0000000        
D   1
  1      0.94733990946E-01            1.0000000        
D   1
  1      0.30479894317E-01            1.0000000        
F   1
  1      0.99540000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Y
data:
YTTRIUM
S   2
  1     12.000000000           -0.27445870024    
  2     10.800000000            0.37995468727    
S   1
  1      3.1007372195           1.0000000        
S   1
  1      0.74155427570          1.0000000        
S   1
  1      0.34176775775          1.0000000        
S   1
  1      0.79428797018E-01            1.0000000        
S   1
  1      0.43308336524E-01            1.0000000        
S   1
  1      0.21593224872E-01            1.0000000        
P   4
  1      8.0336135138           0.73041700172E-01      
  2      4.0181723477          -0.41610436192    
  3      1.1052105890           0.55451897342    
  4      0.83219316692          0.62307196069    
P   1
  1      0.44762676666          1.0000000        
P   1
  1      0.20523347112          1.0000000        
P   1
  1      0.55045561759E-01            1.0000000        
P   1
  1      0.22603027453E-01            1.0000000        
D   4
  1     13.755105347            0.23830583863E-02      
  2      3.9629908552          -0.25068021047E-01      
  3      1.3427449755           0.22348991872    
  4      0.62579248108          0.55237929771    
D   1
  1      0.27632363958          1.0000000        
D   1
  1      0.11706987754          1.0000000        
D   1
  1      0.46601501035E-01            1.0000000        
F   1
  1      0.76291000000          1.0000000        
F   1
  1      0.26515000000          1.0000000        
F   1
  1      0.92150000000E-01            1.0000000        
G   1
  1      0.11149000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Zr
data:
ZIRCONIUM
S   2
  1     13.000000000            0.30219052022    
  2     11.750000000           -0.41145056914    
S   1
  1      3.3679085035           1.0000000        
S   1
  1      0.83813257389          1.0000000        
S   1
  1      0.39094081796          1.0000000        
S   1
  1      0.12165103956          1.0000000        
S   1
  1      0.68995924030E-01            1.0000000        
S   1
  1      0.28131941438E-01            1.0000000        
P   4
  1      8.6639962104           0.73773984271E-01      
  2      4.4109566148          -0.40022747074    
  3      1.2360133871           0.54947233625    
  4      0.87445820593          0.61937721413    
P   1
  1      0.47713887642          1.0000000        
P   1
  1      0.21764845261          1.0000000        
P   1
  1      0.57837163627E-01            1.0000000        
P   1
  1      0.20242456645E-01            1.0000000        
D   4
  1     14.106535710            0.29285547494E-02      
  2      5.0597471810          -0.19680100129E-01      
  3      1.4340490314           0.24763912308    
  4      0.65933129072          0.53572735030    
D   1
  1      0.28894952351          1.0000000        
D   1
  1      0.12160731860          1.0000000        
D   1
  1      0.48470078407E-01            1.0000000        
F   1
  1      1.1417100000           1.0000000        
F   1
  1      0.39261000000          1.0000000        
F   1
  1      0.13501000000          1.0000000        
G   1
  1      0.28989000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Nb
data:
NIOBIUM
S   2
  1     13.500000000           -0.32410606901    
  2     12.200000000            0.44773333772    
S   1
  1      3.7169274051           1.0000000        
S   1
  1      0.90652488058          1.0000000        
S   1
  1      0.41577606051          1.0000000        
S   1
  1      0.11042511303          1.0000000        
S   1
  1      0.62821821279E-01            1.0000000        
S   1
  1      0.28016289999E-01            1.0000000        
P   4
  1      9.3098091725           0.73705483583E-01      
  2      4.8178682975          -0.38234456657    
  3      1.3632838380           0.54987821838    
  4      0.90647526151          0.61931035808    
P   1
  1      0.50089563075          1.0000000        
P   1
  1      0.22793279437          1.0000000        
P   1
  1      0.60000000000E-01            1.0000000        
P   1
  1      0.20600000000E-01            1.0000000        
D   4
  1     17.364404474            0.26413526976E-02      
  2      5.3680385855          -0.20806369564E-01      
  3      1.6586089067           0.24555637053    
  4      0.78121461396          0.53651499644    
D   1
  1      0.34874234803          1.0000000        
D   1
  1      0.14844540532          1.0000000        
D   1
  1      0.59334919015E-01            1.0000000        
F   1
  1      1.5360500000           1.0000000        
F   1
  1      0.52270000000          1.0000000        
F   1
  1      0.17787000000          1.0000000        
G   1
  1      0.46829000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Mo
data:
MOLYBDENUM
S   3
  1     15.000000000            0.57082903143E-01      
  2     13.500000000           -0.66824799324    
  3     12.571764111            0.75521146249    
S   1
  1      4.1304342348           1.0000000        
S   1
  1      0.96478113331          1.0000000        
S   1
  1      0.43736648981          1.0000000        
S   1
  1      0.11318605514          1.0000000        
S   1
  1      0.57579423658E-01            1.0000000        
S   1
  1      0.27018151462E-01            1.0000000        
P   4
  1      9.1087343439           0.10192125262    
  2      5.3495476626          -0.38460279534    
  3      1.4870196599           0.53457134734    
  4      0.90585473836          0.61724117143    
P   1
  1      0.50141240214          1.0000000        
P   1
  1      0.23286318145          1.0000000        
P   1
  1      0.62000000000E-01            1.0000000        
P   1
  1      0.21000000000E-01            1.0000000        
D   4
  1     17.215377137            0.30147475909E-02      
  2      5.8496916871          -0.28923836319E-01      
  3      1.8232967249           0.25398642015    
  4      0.86970233105          0.52725603860    
D   1
  1      0.39461697588          1.0000000        
D   1
  1      0.17084141240          1.0000000        
D   1
  1      0.69272819629E-01            1.0000000        
F   1
  1      1.9462500000           1.0000000        
F   1
  1      0.65545000000          1.0000000        
F   1
  1      0.22074000000          1.0000000        
G   1
  1      0.64670000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Tc
data:
TECHNETIUM
S   3
  1     15.000000000           -0.31349221639    
  2     13.500000000            0.44793618799    
  3      7.1022525122           0.20051786822E-01      
S   1
  1      4.4415995038           1.0000000        
S   1
  1      1.0660127848           1.0000000        
S   1
  1      0.48568559673          1.0000000        
S   1
  1      0.12654965451          1.0000000        
S   1
  1      0.66997954399E-01            1.0000000        
S   1
  1      0.29822104753E-01            1.0000000        
P   4
  1     10.298029968            0.83867175334E-01      
  2      5.7213792785          -0.36246957884    
  3      1.6296063991           0.53649463822    
  4      0.97528623230          0.61837212480    
P   1
  1      0.53997625690          1.0000000        
P   1
  1      0.25172025379          1.0000000        
P   1
  1      0.64000000000E-01            1.0000000        
P   1
  1      0.21500000000E-01            1.0000000        
D   4
  1     18.617708386            0.27056783609E-02      
  2      5.8369803972          -0.35968645824E-01      
  3      2.0921979438           0.21334851537    
  4      1.0148117201           0.45713971996    
D   1
  1      0.46154215497          1.0000000        
D   1
  1      0.19795071041          1.0000000        
D   1
  1      0.78619872304E-01            1.0000000        
F   1
  1      2.3724000000           1.0000000        
F   1
  1      0.79080000000          1.0000000        
F   1
  1      0.26360000000          1.0000000        
G   1
  1      0.82510000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ru
data:
RUTHENIUM
S   3
  1     15.000000000            0.40205707045    
  2     13.500000000           -0.59417167365    
  3      7.2130868530           0.12541032854    
S   1
  1      4.5405901225           1.0000000        
S   1
  1      1.1904973723           1.0000000        
S   1
  1      0.54307531590          1.0000000        
S   1
  1      0.13700563039          1.0000000        
S   1
  1      0.73396375028E-01            1.0000000        
S   1
  1      0.31250715458E-01            1.0000000        
P   4
  1     11.388100061            0.55871461629E-01      
  2      6.1591005666          -0.25808446847    
  3      1.7320431063           0.42924265341    
  4      1.0194857402           0.43313353048    
P   1
  1      0.58131419111          1.0000000        
P   1
  1      0.27290530268          1.0000000        
P   1
  1      0.66000000000E-01            1.0000000        
P   1
  1      0.22000000000E-01            1.0000000        
D   4
  1     18.598247778            0.31556859652E-02      
  2      6.7883773752          -0.34551060293E-01      
  3      2.2470797667           0.21708566158    
  4      1.0884195428           0.42834135307    
D   1
  1      0.49787892886          1.0000000        
D   1
  1      0.21481968266          1.0000000        
D   1
  1      0.85666751170E-01            1.0000000        
F   1
  1      2.8246600000           1.0000000        
F   1
  1      0.94314000000          1.0000000        
F   1
  1      0.31491000000          1.0000000        
G   1
  1      1.0093000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Rh
data:
RHODIUM
S   3
  1     15.000000000            0.50258059140    
  2     13.500000000           -0.76433277918    
  3      7.4051116103           0.31145290674    
S   1
  1      4.5131696431           1.0000000        
S   1
  1      1.3235977422           1.0000000        
S   1
  1      0.60954144541          1.0000000        
S   1
  1      0.18907192773          1.0000000        
S   1
  1      0.89080450794E-01            1.0000000        
S   1
  1      0.34131567514E-01            1.0000000        
P   4
  1     11.839425278            0.59787418531E-01      
  2      6.6953652636          -0.24743454054    
  3      1.8333616287           0.42987003231    
  4      1.0267931770           0.42547313311    
P   1
  1      0.58071767020          1.0000000        
P   1
  1      0.27907753269          1.0000000        
P   1
  1      0.67108954625E-01            1.0000000        
P   1
  1      0.22101542156E-01            1.0000000        
D   4
  1     26.341167176            0.20623159685E-02      
  2      7.8709462705          -0.17239329053E-01      
  3      2.5989970939           0.17284839402    
  4      1.2613435752           0.36282102279    
D   1
  1      0.57578407979          1.0000000        
D   1
  1      0.24725174897          1.0000000        
D   1
  1      0.97531210324E-01            1.0000000        
F   1
  1      3.2739100000           1.0000000        
F   1
  1      1.0949900000           1.0000000        
F   1
  1      0.36623000000          1.0000000        
G   1
  1      1.1935000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Pd
data:
PALLADIUM
S   3
  1     15.262399331            0.44145727454    
  2     13.721983176           -0.70293005979    
  3      4.8448286268           0.36095390108    
S   1
  1      8.7309326588           1.0000000        
S   1
  1      1.4357564094           1.0000000        
S   1
  1      0.66088433720          1.0000000        
S   1
  1      0.20897212790          1.0000000        
S   1
  1      0.91936735872E-01            1.0000000        
S   1
  1      0.34733479706E-01            1.0000000        
P   4
  1     12.585237008            0.60002003747E-01      
  2      7.2058104839          -0.24022183118    
  3      1.9558705640           0.43424940067    
  4      1.0534418618           0.42084436088    
P   1
  1      0.59809389552          1.0000000        
P   1
  1      0.30362411297          1.0000000        
P   1
  1      0.88000000000E-01            1.0000000        
P   1
  1      0.30000000000E-01            1.0000000        
D   4
  1     28.840985892            0.21131470308E-02      
  2      8.4584163440          -0.17913194955E-01      
  3      2.8648941754           0.17165507663    
  4      1.3966488847           0.36149251150    
D   1
  1      0.63921677230          1.0000000        
D   1
  1      0.27502319836          1.0000000        
D   1
  1      0.10829940074          1.0000000        
F   1
  1      3.7200000000           1.0000000        
F   1
  1      1.2462900000           1.0000000        
F   1
  1      0.41754000000          1.0000000        
G   1
  1      1.3777000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ag
data:
SILVER
S   4
  1    256.50898381             0.73215128094E-03      
  2     19.000000000           -0.14706983774    
  3     14.129749737            0.47914881797    
  4      9.4840599768          -0.26930801705    
S   1
  1      5.5812682897           1.0000000        
S   1
  1      1.4763753299           1.0000000        
S   1
  1      0.66184584335          1.0000000        
S   1
  1      0.15382171742          1.0000000        
S   1
  1      0.79534248689E-01            1.0000000        
S   1
  1      0.32408624506E-01            1.0000000        
P   4
  1     13.350389537            0.62479151672E-01      
  2      7.7163302467          -0.24398688175    
  3      2.0864535219           0.45439758415    
  4      1.0577805733           0.47607485340    
P   1
  1      0.52564427657          1.0000000        
P   1
  1      0.23694908895          1.0000000        
P   1
  1      0.66457980332E-01            1.0000000        
P   1
  1      0.21864839286E-01            1.0000000        
D   4
  1     32.147961274            0.34564677092E-02      
  2      9.0323725307          -0.28135297216E-01      
  3      3.1673540854           0.26999486025    
  4      1.5519381135           0.57666767772    
D   1
  1      0.71310284000          1.0000000        
D   1
  1      0.30749741551          1.0000000        
D   1
  1      0.12094304210          1.0000000        
F   1
  1      4.1631100000           1.0000000        
F   1
  1      1.3971100000           1.0000000        
F   1
  1      0.46886000000          1.0000000        
G   1
  1      1.5619000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Cd
data:
CADMIUM
S   4
  1    269.30016289             0.62688949336E-03      
  2     18.554269093           -0.43456616075    
  3     16.729943183            0.66043072415    
  4     11.768546646           -0.11793513277    
S   1
  1      6.1816604427           1.0000000        
S   1
  1      1.5775743989           1.0000000        
S   1
  1      0.71857981187          1.0000000        
S   1
  1      0.16433138409          1.0000000        
S   1
  1      0.76794158768E-01            1.0000000        
S   1
  1      0.34377199848E-01            1.0000000        
P   4
  1     14.107678180            0.70307291426E-01      
  2      8.2750040714          -0.26474818030    
  3      2.2507338323           0.47494851120    
  4      1.1914970238           0.46327020832    
P   1
  1      0.66041257699          1.0000000        
P   1
  1      0.33804403770          1.0000000        
P   1
  1      0.96004037879E-01            1.0000000        
P   1
  1      0.33681030012E-01            1.0000000        
D   4
  1     35.689192548            0.44455913982E-02      
  2      9.3407971610          -0.39185351747E-01      
  3      3.5922659140           0.31235972097    
  4      1.7980676976           0.71163739606    
D   1
  1      0.84830057791          1.0000000        
D   1
  1      0.37846492753          1.0000000        
D   1
  1      0.15420101631          1.0000000        
F   1
  1      4.7689900000           1.0000000        
F   1
  1      1.5981300000           1.0000000        
F   1
  1      0.53555000000          1.0000000        
G   1
  1      1.7896000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: In
data:
INDIUM
S   9
  1   8931.8400000              0.19000000000E-04      
  2   1352.2200000              0.13100000000E-03      
  3    303.39300000             0.47800000000E-03      
  4     45.122900000            0.11708000000E-01      
  5     28.182200000           -0.87330000000E-01      
  6     17.604800000            0.25957700000    
  7      6.9405800000          -0.62847100000    
  8      4.3337700000          -0.15871800000    
  9      1.9868400000           0.67440400000    
S   3
  1     20.245544208            0.29650296199E-01      
  2     11.072298416           -0.14745372687    
  3      2.4929238916           0.53232061960    
S   1
  1      1.0438672413           1.0000000        
S   1
  1      0.53244484157          1.0000000        
S   1
  1      0.21211307407          1.0000000        
S   1
  1      0.95475196519E-01            1.0000000        
S   1
  1      0.42357644919E-01            1.0000000        
S   1
  1      0.18349388883E-01            1.0000000        
P   7
  1    129.23300000             0.27900000000E-03      
  2     29.628400000           -0.61710000000E-02      
  3     18.521100000            0.46912000000E-01      
  4      8.2853600000          -0.23990400000    
  5      2.4993900000           0.42981100000    
  6      1.3221600000           0.48610100000    
  7      0.68870700000          0.22203700000    
P   3
  1     13.248633034           -0.18203004609E-01      
  2      3.0240161259           0.31476939453    
  3      1.0805448379           0.71919648136    
P   1
  1      0.33353581509          1.0000000        
P   1
  1      0.15403760449          1.0000000        
P   1
  1      0.65770424632E-01            1.0000000        
P   1
  1      0.27642180293E-01            1.0000000        
D   8
  1    131.81131820             0.22281463414E-03      
  2     37.030875816            0.19331306797E-02      
  3     11.378665218           -0.17870304080E-01      
  4      6.4488212086           0.22953424346E-01      
  5      3.4878752216           0.17536747821    
  6      1.9912337572           0.29288830616    
  7      1.1306610212           0.31018960851    
  8      0.63074842914          0.24247651565    
D   1
  1      0.33856463907          1.0000000        
D   1
  1      0.17026198815          1.0000000        
D   1
  1      0.69200000000E-01            1.0000000        
D   1
  1      0.26760246554E-01            1.0000000        
F   1
  1      0.39210000000          1.0000000        
F   1
  1      0.15600000000          1.0000000        
F   1
  1      1.3983200000           1.0000000        
F   1
  1      4.1949600000           1.0000000        
G   1
  1      0.34190000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Sn
data:
TIN
S   9
  1  11606.9000000              0.29000000000E-04      
  2   1754.8000000              0.20600000000E-03      
  3    397.17800000             0.80700000000E-03      
  4     90.299000000            0.24710000000E-02      
  5     31.489000000           -0.40025000000E-01      
  6     19.668500000            0.16315200000    
  7      7.0675900000          -0.55698300000    
  8      4.4149000000          -0.16993200000    
  9      2.1635600000           0.65102800000    
S   3
  1     20.197961274            0.22393937317E-01      
  2     10.880108426           -0.14330764814    
  3      2.7745387028           0.53278527074    
S   1
  1      1.1440977736           1.0000000        
S   1
  1      0.58550056279          1.0000000        
S   1
  1      0.25317089836          1.0000000        
S   1
  1      0.11599461634          1.0000000        
S   1
  1      0.52233584109E-01            1.0000000        
S   1
  1      0.24028839891E-01            1.0000000        
P   7
  1    195.49500000             0.25800000000E-03      
  2     18.256300000            0.44341000000E-01      
  3     11.409400000           -0.10914200000    
  4      6.9056700000          -0.13860600000    
  5      2.9820600000           0.34374300000    
  6      1.6084300000           0.51827100000    
  7      0.83176700000          0.27870600000    
P   3
  1     13.304065745           -0.20694775410E-01      
  2      3.4193503621           0.33654593033    
  3      1.2382899573           0.71397757129    
P   1
  1      0.39265300321          1.0000000        
P   1
  1      0.19313059747          1.0000000        
P   1
  1      0.86443518729E-01            1.0000000        
P   1
  1      0.37350684674E-01            1.0000000        
D   8
  1    143.82134199             0.26165602862E-03      
  2     41.039940764            0.21562117321E-02      
  3     11.508999207           -0.24771286642E-01      
  4      8.4312612820           0.29022163379E-01      
  5      4.0180001346           0.16171344601    
  6      2.3122021836           0.29213521578    
  7      1.3168562511           0.32241037254    
  8      0.73729126651          0.24629433031    
D   1
  1      0.40109472811          1.0000000        
D   1
  1      0.20593354535          1.0000000        
D   1
  1      0.86600000000E-01            1.0000000        
D   1
  1      0.35066313113E-01            1.0000000        
F   1
  1      0.43150000000          1.0000000        
F   1
  1      0.17720000000          1.0000000        
F   1
  1      1.5915400000           1.0000000        
F   1
  1      4.7988893935           1.0000000        
G   1
  1      0.37740000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Sb
data:
ANTIMONY
S   9
  1  12339.3165550              0.38545231046E-04      
  2   1854.7043271              0.27702166404E-03      
  3    418.44441772             0.11161923778E-02      
  4     96.965111109            0.28828055377E-02      
  5     28.537960267           -0.60556405021E-01      
  6     17.862907144            0.27988835315    
  7      8.4541754812          -0.54748479396    
  8      5.2813981306          -0.30336289748    
  9      2.3194618632           0.68093278701    
S   3
  1     25.336266601            0.22414355064E-01      
  2     12.477043309           -0.14737811818    
  3      3.0723142741           0.53278468779    
S   1
  1      1.2167512076           1.0000000        
S   1
  1      0.60174774699          1.0000000        
S   1
  1      0.28323936354          1.0000000        
S   1
  1      0.13221765728          1.0000000        
S   1
  1      0.60986718951E-01            1.0000000        
S   1
  1      0.29538557139E-01            1.0000000        
P   7
  1    162.89300000             0.37500000000E-03      
  2     30.399600000           -0.47980000000E-02      
  3     19.000400000            0.54731000000E-01      
  4      9.3225600000          -0.25528400000    
  5      3.0166800000           0.34537700000    
  6      1.8621900000           0.40483300000    
  7      1.1033100000           0.32592200000    
P   3
  1     12.665326113           -0.20694788562E-01      
  2      3.3473442879           0.26878411014    
  3      1.1722158971           0.72590523998    
P   1
  1      0.58886745483          1.0000000        
P   1
  1      0.25014249608          1.0000000        
P   1
  1      0.11120161090          1.0000000        
P   1
  1      0.48206685448E-01            1.0000000        
D   8
  1    142.61790051             0.34691704136E-03      
  2     40.920334292            0.27417583490E-02      
  3     10.854520545           -0.33847404142E-01      
  4      8.3926457719           0.42753986065E-01      
  5      4.1806878019           0.16545099365    
  6      2.5346474124           0.26821979719    
  7      1.5175455555           0.31482077294    
  8      0.86799625994          0.25485913704    
D   1
  1      0.47323070711          1.0000000        
D   1
  1      0.24111763234          1.0000000        
D   1
  1      0.10080000000          1.0000000        
D   1
  1      0.42644475881E-01            1.0000000        
F   1
  1      0.48490000000          1.0000000        
F   1
  1      0.20490000000          1.0000000        
F   1
  1      1.7880600000           1.0000000        
F   1
  1      5.6265581363           1.0000000        
G   1
  1      0.42340000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Te
data:
TELLURIUM
S   9
  1  15746.3000000              0.54000000000E-04      
  2   2369.2500000              0.39800000000E-03      
  3    535.86000000             0.16620000000E-02      
  4    141.88500000             0.36360000000E-02      
  5     27.819700000           -0.58427000000E-01      
  6     17.387900000            0.36652000000    
  7     10.865600000           -0.39758900000    
  8      6.5688500000          -0.51917500000    
  9      2.4013900000           0.68765200000    
S   3
  1     29.383253023            0.30079778033E-01      
  2     15.946408003           -0.13631630929    
  3      3.6679902632           0.53467574034    
S   1
  1      1.2865441585           1.0000000        
S   1
  1      0.63533594694          1.0000000        
S   1
  1      0.29807786206          1.0000000        
S   1
  1      0.14061248688          1.0000000        
S   1
  1      0.65660655893E-01            1.0000000        
S   1
  1      0.30602910356E-01            1.0000000        
P   7
  1    750.22200000             0.52000000000E-04      
  2    163.96100000             0.41000000000E-03      
  3     16.922700000            0.83387000000E-01      
  4     10.575500000           -0.26821200000    
  5      5.7046200000          -0.22932000000E-01      
  6      2.9802200000           0.49554800000    
  7      1.5197000000           0.51452200000    
P   3
  1     13.925457258           -0.21336842159E-01      
  2      4.2323766654           0.22433961554    
  3      1.4547630727           0.73198528158    
P   1
  1      0.75528783692          1.0000000        
P   1
  1      0.31829451168          1.0000000        
P   1
  1      0.13721830923          1.0000000        
P   1
  1      0.57099171462E-01            1.0000000        
P   1
  1      0.18390619948E-01            1.0000000        
D   8
  1    146.30727119             0.43816018982E-03      
  2     42.243859354            0.33559305599E-02      
  3      9.9155377745          -0.11157186771    
  4      8.9949643607           0.13269569633    
  5      4.1376628430           0.21574044755    
  6      2.3659339431           0.32583679541    
  7      1.3736141857           0.30685918052    
  8      0.79846379228          0.19445241192    
D   1
  1      0.45685175394          1.0000000        
D   1
  1      0.25022747959          1.0000000        
D   1
  1      0.11560000000          1.0000000        
D   1
  1      0.46388906345E-01            1.0000000        
F   1
  1      0.51840000000          1.0000000        
F   1
  1      0.21350000000          1.0000000        
F   1
  1      1.9347800000           1.0000000        
F   1
  1      5.8043400000           1.0000000        
G   1
  1      0.42940000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: I
data:
IODINE
S   9
  1  16788.4000000              0.41000000000E-04      
  2   2526.6400000              0.30300000000E-03      
  3    571.98400000             0.12470000000E-02      
  4    150.43400000             0.26590000000E-02      
  5     29.540500000           -0.53190000000E-01      
  6     18.457100000            0.34009600000    
  7     11.528600000           -0.35235500000    
  8      7.0828900000          -0.54138500000    
  9      2.5040500000           0.71574900000    
S   3
  1     25.058617933            0.40897754402E-01      
  2     15.621979372           -0.14269668187    
  3      3.3536325162           0.52916319279    
S   1
  1      1.3540144781           1.0000000        
S   1
  1      0.67430472704          1.0000000        
S   1
  1      0.32727136949          1.0000000        
S   1
  1      0.15749364119          1.0000000        
S   1
  1      0.74377727841E-01            1.0000000        
S   1
  1      0.35555048604E-01            1.0000000        
P   7
  1    656.27400000             0.91000000000E-04      
  2    149.23200000             0.61300000000E-03      
  3     19.015300000            0.59923000000E-01      
  4     10.737800000           -0.24925800000    
  5      6.4420800000          -0.43750000000E-02      
  6      3.0920300000           0.51399900000    
  7      1.5787400000           0.50721300000    
P   3
  1     15.660511893           -0.22143803592E-01      
  2      4.9250669812           0.23518064355    
  3      1.6692319982           0.73153925548    
P   1
  1      0.77817898176          1.0000000        
P   1
  1      0.35608843716          1.0000000        
P   1
  1      0.15493242649          1.0000000        
P   1
  1      0.64666212492E-01            1.0000000        
P   1
  1      0.18667676825E-01            1.0000000        
D   8
  1    318.22407776             0.10951692560E-03      
  2     95.810227352            0.91919139268E-03      
  3     35.322295259            0.47916935207E-02      
  4     13.107447819           -0.16280459996E-01      
  5      6.2949152988           0.90889609141E-01      
  6      3.6826101201           0.27483543784    
  7      2.0858950647           0.36067901632    
  8      1.1644342344           0.28384002219    
D   1
  1      0.63180613129          1.0000000        
D   1
  1      0.32215084697          1.0000000        
D   1
  1      0.13490000000          1.0000000        
D   1
  1      0.54429373911E-01            1.0000000        
F   1
  1      0.58650000000          1.0000000        
F   1
  1      0.24940000000          1.0000000        
F   1
  1      2.1780000000           1.0000000        
F   1
  1      6.4253613600           1.0000000        
G   1
  1      0.47300000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Xe
data:
XENON
S   9
  1  18774.3000000              0.68000000000E-04      
  2   2824.8100000              0.50100000000E-03      
  3    640.08800000             0.20970000000E-02      
  4    172.61600000             0.44930000000E-02      
  5     29.516900000           -0.47151000000E-01      
  6     18.444800000            0.37403300000    
  7     11.523800000           -0.51282600000    
  8      6.6189000000          -0.47862400000    
  9      2.9955200000           0.59647100000    
S   3
  1     27.052171835            0.11189611954    
  2     20.940622415           -0.24055422724    
  3      6.0024591071           0.51452076187    
S   1
  1      1.6532586536           1.0000000        
S   1
  1      0.87553889270          1.0000000        
S   1
  1      0.41033616654          1.0000000        
S   1
  1      0.19493585779          1.0000000        
S   1
  1      0.90171093041E-01            1.0000000        
S   1
  1      0.42287348590E-01            1.0000000        
P   7
  1    613.33100000             0.13800000000E-03      
  2    141.71000000             0.85300000000E-03      
  3     20.310600000            0.55024000000E-01      
  4     11.033100000           -0.25298800000    
  5      6.8951300000           0.97460000000E-02      
  6      3.2416600000           0.52679700000    
  7      1.6653500000           0.50183200000    
P   3
  1     18.388908413           -0.24514446229E-01      
  2      6.1139045431           0.25265669670    
  3      1.8729815691           0.72938328969    
P   1
  1      0.82004665991          1.0000000        
P   1
  1      0.39552648254          1.0000000        
P   1
  1      0.17445509815          1.0000000        
P   1
  1      0.73389992663E-01            1.0000000        
P   1
  1      0.19994004440E-01            1.0000000        
D   8
  1    315.66106865             0.14235585191E-03      
  2     95.553873651            0.11707875751E-02      
  3     35.451236301            0.58783160362E-02      
  4     13.153211283           -0.16764226287E-01      
  5      6.3847329564           0.11558421625    
  6      3.6968166410           0.30375919653    
  7      2.0976070364           0.36037726827    
  8      1.1951246616           0.24813434400    
D   1
  1      0.68431725339          1.0000000        
D   1
  1      0.37710480204          1.0000000        
D   1
  1      0.16760000000          1.0000000        
D   1
  1      0.65304298484E-01            1.0000000        
F   1
  1      0.66190000000          1.0000000        
F   1
  1      0.29790000000          1.0000000        
F   1
  1      2.4323000000           1.0000000        
F   1
  1      7.2077391789           1.0000000        
G   1
  1      0.52780000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Cs
data:
CESIUM
S   3
  1      5.8684829520           0.12906631816    
  2      4.3741038860          -0.34380446158    
  3      1.7951201473           0.69937346606    
S   1
  1      0.37816941125          1.0000000        
S   1
  1      0.16624693130          1.0000000        
S   1
  1      0.27763176052E-01            1.0000000        
S   1
  1      0.16113005842E-01            1.0000000        
S   1
  1      0.10996108743E-01            1.0000000        
P   3
  1      4.2749775718           0.45595316685E-01      
  2      1.9639316240          -0.25031125651    
  3      0.47666322385          0.55660114378    
P   1
  1      0.21736718772          1.0000000        
P   1
  1      0.97276293828E-01            1.0000000        
P   1
  1      0.26770518041E-01            1.0000000        
P   1
  1      0.10845412222E-01            1.0000000        
D   2
  1      2.0091044335          -0.34453182058E-02      
  2      0.35778351451          0.22686596025    
D   1
  1      0.11070568254          1.0000000        
D   1
  1      0.33216214821E-01            1.0000000        
D   1
  1      0.11409380652E-01            1.0000000        
F   1
  1      0.58777000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ba
data:
BARIUM
S   2
  1      5.7000000000           1.3292982002     
  2      5.2043612469          -1.7367497134     
S   1
  1      2.1475437282           1.0000000        
S   1
  1      0.41033660537          1.0000000        
S   1
  1      0.18393532770          1.0000000        
S   1
  1      0.72521216545E-01            1.0000000        
S   1
  1      0.34526334903E-01            1.0000000        
S   1
  1      0.16157891872E-01            1.0000000        
P   4
  1      5.6000000000           0.51385026013    
  2      5.1104879274          -0.70529238864    
  3      2.5006544803           0.42822329830    
  4      0.51947995345         -0.57125984472    
P   1
  1      0.24536994841          1.0000000        
P   1
  1      0.11256056700          1.0000000        
P   1
  1      0.34917622027E-01            1.0000000        
P   1
  1      0.16320065666E-01            1.0000000        
D   3
  1      2.7000000000           0.14372069824    
  2      2.3460740881          -0.19565347309    
  3      0.39553542609          0.29963058552    
D   1
  1      0.12967935859          1.0000000        
D   1
  1      0.40463066544E-01            1.0000000        
F   1
  1      0.65760000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: La
data:
LANTHANUM
S   3
  1     26.077272000            0.23198684846E-02      
  2      5.7127838000          -0.29787719611    
  3      4.4057848000           0.70022722515    
S   1
  1      2.1315325829           1.0000000        
S   1
  1      0.49385808956          1.0000000        
S   1
  1      0.23595687888          1.0000000        
S   1
  1      0.63593489661E-01            1.0000000        
S   1
  1      0.31545394754E-01            1.0000000        
S   1
  1      0.15777655296E-01            1.0000000        
P   4
  1      6.0000000000          -0.11397960924E-01      
  2      3.6808191615           0.14675038550    
  3      2.3265462081          -0.35581819167    
  4      0.64342629633          0.45834955229    
P   1
  1      0.33584281962          1.0000000        
P   1
  1      0.16519051916          1.0000000        
P   1
  1      0.56715971797E-01            1.0000000        
P   1
  1      0.22100824776E-01            1.0000000        
D   3
  1      1.2000000000          -0.35803482414    
  2      1.0239524401           0.40483734122    
  3      0.37508490282          0.37649639849    
D   1
  1      0.17161940245          1.0000000        
D   1
  1      0.78780423402E-01            1.0000000        
D   1
  1      0.35000047794E-01            1.0000000        
F   1
  1      0.65580000000          1.0000000        
F   1
  1      0.25683000000          1.0000000        
F   1
  1      0.10058000000          1.0000000        
G   1
  1      0.17907000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Hf
data:
HAFNIUM
S   4
  1     24.000000000            0.19369448644    
  2     16.000000000           -3.5064630782     
  3     14.400000000            4.3082581000     
  4     10.304504667           -0.91045809742    
S   1
  1      3.8372797792           1.0000000        
S   1
  1      0.94649028050          1.0000000        
S   1
  1      0.44397931299          1.0000000        
S   1
  1      0.13656009445          1.0000000        
S   1
  1      0.66549732509E-01            1.0000000        
S   1
  1      0.28719110054E-01            1.0000000        
P   4
  1     17.000000000           -0.30316491880E-01      
  2     11.738072097            0.10139279686    
  3      4.9203967161          -0.28227924657    
  4      1.1251726138           0.52032008501    
P   1
  1      0.54220114055          1.0000000        
P   1
  1      0.25659447877          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
P   1
  1      0.20187520429E-01            1.0000000        
D   3
  1      6.9644775309           0.90606952386E-01      
  2      5.7275227587          -0.16459899714    
  3      1.1503305416           0.51375718250    
D   1
  1      0.47559482991          1.0000000        
D   1
  1      0.18774414759          1.0000000        
D   1
  1      0.68439488104E-01            1.0000000        
F   1
  1      0.80387000000          1.0000000        
F   1
  1      0.31547000000          1.0000000        
F   1
  1      0.12380000000          1.0000000        
G   1
  1      0.29036000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ta
data:
TANTALUM
S   4
  1     24.473650944            0.20537515818    
  2     18.721372549           -0.74477445680    
  3     11.500000000            3.4067771001     
  4     10.350000000           -2.8222400335     
S   1
  1      3.8125414615           1.0000000        
S   1
  1      1.0507430630           1.0000000        
S   1
  1      0.49732275755          1.0000000        
S   1
  1      0.15602650970          1.0000000        
S   1
  1      0.75056442354E-01            1.0000000        
S   1
  1      0.31632668803E-01            1.0000000        
P   4
  1     17.000000000           -0.32577305616E-01      
  2     12.008186536            0.10336287365    
  3      5.0278760583          -0.28526521696    
  4      1.1937124184           0.51790141155    
P   1
  1      0.57889707053          1.0000000        
P   1
  1      0.27225198801          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
P   1
  1      0.20413673674E-01            1.0000000        
D   3
  1      7.1419762952           0.88606814221E-01      
  2      5.7696869171          -0.17156962221    
  3      1.2199483941           0.53547693505    
D   1
  1      0.52366034246          1.0000000        
D   1
  1      0.21384808767          1.0000000        
D   1
  1      0.80254256735E-01            1.0000000        
F   1
  1      0.95070000000          1.0000000        
F   1
  1      0.37386000000          1.0000000        
F   1
  1      0.14702000000          1.0000000        
G   1
  1      0.40165000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: W
data:
TUNGSTEN
S   4
  1     22.106487883            0.66320504570    
  2     18.958062620           -1.5576189160     
  3     13.128699049            2.1416485467     
  4     10.149417378           -1.1823364947     
S   1
  1      4.0160322414           1.0000000        
S   1
  1      1.1234496158           1.0000000        
S   1
  1      0.53500662821          1.0000000        
S   1
  1      0.17127449658          1.0000000        
S   1
  1      0.80452897876E-01            1.0000000        
S   1
  1      0.33669872229E-01            1.0000000        
P   4
  1     17.000000000           -0.37817768433E-01      
  2     12.431973432            0.10905673845    
  3      5.1586217658          -0.29399955020    
  4      1.2801454812           0.51560726697    
P   1
  1      0.62856790898          1.0000000        
P   1
  1      0.29380423553          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
P   1
  1      0.20637836728E-01            1.0000000        
D   3
  1      7.4064737315           0.86993963018E-01      
  2      5.9026268603          -0.17667540011    
  3      1.2984756750           0.55145697030    
D   1
  1      0.57153508541          1.0000000        
D   1
  1      0.23845526606          1.0000000        
D   1
  1      0.91144267331E-01            1.0000000        
F   1
  1      1.0962400000           1.0000000        
F   1
  1      0.43199000000          1.0000000        
F   1
  1      0.17023000000          1.0000000        
G   1
  1      0.51293000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Re
data:
RHENIUM
S   4
  1     24.000000000            0.26968047163    
  2     18.204262749           -1.3559378623     
  3     14.048192487            1.9003709759     
  4      9.5166786954          -0.75626964015    
S   1
  1      4.1714667981           1.0000000        
S   1
  1      1.1944213976           1.0000000        
S   1
  1      0.56755447797          1.0000000        
S   1
  1      0.17533854868          1.0000000        
S   1
  1      0.82014250464E-01            1.0000000        
S   1
  1      0.34607892740E-01            1.0000000        
P   4
  1     18.000000000           -0.26890962397E-01      
  2     12.318606250            0.99711498502E-01      
  3      5.3719234505          -0.29289398145    
  4      1.3506646748           0.51466301434    
P   1
  1      0.66212816808          1.0000000        
P   1
  1      0.31071385193          1.0000000        
P   1
  1      0.10800000000          1.0000000        
P   1
  1      0.45000000000E-01            1.0000000        
P   1
  1      0.21930251666E-01            1.0000000        
D   3
  1      7.7352877672           0.83901798556E-01      
  2      6.0949443610          -0.17722258734    
  3      1.3871105497           0.55238259692    
D   1
  1      0.62324027854          1.0000000        
D   1
  1      0.26517328547          1.0000000        
D   1
  1      0.10321096849          1.0000000        
F   1
  1      1.2406000000           1.0000000        
F   1
  1      0.48989000000          1.0000000        
F   1
  1      0.19345000000          1.0000000        
G   1
  1      0.62422000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Os
data:
OSMIUM
S   4
  1     24.000000000            0.24559132972    
  2     18.204262749           -1.3020204925     
  3     14.048192487            1.9114896000     
  4      9.5166786954          -0.83098846799    
S   1
  1      4.2529406042           1.0000000        
S   1
  1      1.2999583502           1.0000000        
S   1
  1      0.61756850127          1.0000000        
S   1
  1      0.18785305474          1.0000000        
S   1
  1      0.87865523960E-01            1.0000000        
S   1
  1      0.37004242944E-01            1.0000000        
P   4
  1     15.500000000            0.16016463376    
  2     14.000000000           -0.23201520402    
  3      5.5458290420           0.29772587274    
  4      1.4139502215          -0.54253238176    
P   1
  1      0.68136686765          1.0000000        
P   1
  1      0.30911452647          1.0000000        
P   1
  1      0.90000000000E-01            1.0000000        
P   1
  1      0.33000000000E-01            1.0000000        
D   3
  1      8.5557226523           0.55081304746E-01      
  2      6.1927250845          -0.15041777374    
  3      1.4916733698           0.55087247584    
D   1
  1      0.67423241512          1.0000000        
D   1
  1      0.28635737076          1.0000000        
D   1
  1      0.11074292707          1.0000000        
F   1
  1      1.3802600000           1.0000000        
F   1
  1      0.55065000000          1.0000000        
F   1
  1      0.21968000000          1.0000000        
G   1
  1      0.75489000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Ir
data:
IRIDIUM
S   4
  1     23.465507222            0.71085679679    
  2     20.657091116           -1.5723547785     
  3     15.725107858            1.2938086001     
  4      7.9297463605          -0.42980466966    
S   1
  1      4.5196120103           1.0000000        
S   1
  1      1.3392891402           1.0000000        
S   1
  1      0.63692276928          1.0000000        
S   1
  1      0.19126770642          1.0000000        
S   1
  1      0.87881999015E-01            1.0000000        
S   1
  1      0.37643105533E-01            1.0000000        
P   4
  1     15.902664143           -0.16290720099    
  2     14.415830698            0.23483212987    
  3      5.7597608991          -0.30305337176    
  4      1.5008913108           0.55512982069    
P   1
  1      0.72348035957          1.0000000        
P   1
  1      0.32785980328          1.0000000        
P   1
  1      0.91000000000E-01            1.0000000        
P   1
  1      0.35000000000E-01            1.0000000        
D   3
  1      8.9686781612           0.29754685954E-01      
  2      6.4456319498          -0.82246052942E-01      
  3      1.5835819740           0.29212392062    
D   1
  1      0.71871917882          1.0000000        
D   1
  1      0.30539233284          1.0000000        
D   1
  1      0.11791405498          1.0000000        
F   1
  1      1.5134800000           1.0000000        
F   1
  1      0.61008000000          1.0000000        
F   1
  1      0.24592000000          1.0000000        
G   1
  1      0.88556000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Pt
data:
PLATINUM
S   4
  1     23.465507222            0.55150926143    
  2     20.657091116           -1.2690274107     
  3     15.725107858            1.1215145470     
  4      7.9297463605          -0.42250178029    
S   1
  1      4.6667116243           1.0000000        
S   1
  1      1.4202522633           1.0000000        
S   1
  1      0.66786671541          1.0000000        
S   1
  1      0.19745059689          1.0000000        
S   1
  1      0.92573920368E-01            1.0000000        
S   1
  1      0.38895936899E-01            1.0000000        
P   4
  1     15.500000000           -0.15672718629    
  2     14.000000000            0.23853412989    
  3      6.1161212339          -0.31041379733    
  4      1.5715586385           0.56473525089    
P   1
  1      0.75132510781          1.0000000        
P   1
  1      0.33306466812          1.0000000        
P   1
  1      0.91000000000E-01            1.0000000        
P   1
  1      0.35000000000E-01            1.0000000        
D   3
  1      8.3207937611           0.62945508668E-01      
  2      7.4207226520          -0.90271154330E-01      
  3      1.6570410639           0.16812340903    
D   1
  1      0.73943569960          1.0000000        
D   1
  1      0.30508290090          1.0000000        
D   1
  1      0.11350435924          1.0000000        
F   1
  1      1.6402500000           1.0000000        
F   1
  1      0.66813000000          1.0000000        
F   1
  1      0.27215000000          1.0000000        
G   1
  1      1.0162300000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Au
data:
GOLD
S   3
  1     24.200000000            1.4645004443     
  2     22.000000000           -3.9770190496     
  3     20.000000000            2.7298033533     
S   1
  1      5.4043553001           1.0000000        
S   1
  1      1.4532546773           1.0000000        
S   1
  1      0.68294298420          1.0000000        
S   1
  1      0.19002755303          1.0000000        
S   1
  1      0.88155981740E-01            1.0000000        
S   1
  1      0.37739555187E-01            1.0000000        
P   4
  1     15.500000000            0.15001711880    
  2     14.000000000           -0.23609813183    
  3      6.4227368205           0.31458896948    
  4      1.6595601681          -0.57279670446    
P   1
  1      0.79402913993          1.0000000        
P   1
  1      0.35125155397          1.0000000        
P   1
  1      0.81000000000E-01            1.0000000        
P   1
  1      0.25000000000E-01            1.0000000        
D   3
  1      8.6000000000           0.15361654684    
  2      7.8531899379          -0.20443530663    
  3      1.7650856798           0.30781811607    
D   1
  1      0.79482263260          1.0000000        
D   1
  1      0.33085396360          1.0000000        
D   1
  1      0.12398535801          1.0000000        
F   1
  1      1.7607400000           1.0000000        
F   1
  1      0.72482000000          1.0000000        
F   1
  1      0.29838000000          1.0000000        
G   1
  1      1.1469000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Hg
data:
MERCURY
S   3
  1     48.013786990            0.56241403333E-02      
  2     21.239875095           -0.17054083503    
  3     15.876100879            0.35940389661    
S   1
  1      5.4865939429           1.0000000        
S   1
  1      1.5521766895           1.0000000        
S   1
  1      0.74742541187          1.0000000        
S   1
  1      0.20268838483          1.0000000        
S   1
  1      0.93376229211E-01            1.0000000        
S   1
  1      0.41248705609E-01            1.0000000        
P   4
  1     17.500000000           -0.86457187331E-01      
  2     15.252594855            0.15327318234    
  3      6.4404715169          -0.30274955249    
  4      1.8180159920           0.54361285026    
P   1
  1      0.90067981801          1.0000000        
P   1
  1      0.41304540122          1.0000000        
P   1
  1      0.11845702655          1.0000000        
P   1
  1      0.36087619349E-01            1.0000000        
D   4
  1     11.888648987            0.13311219898E-01      
  2      6.7773660954          -0.73346199848E-01      
  3      2.0934941340           0.24155986719    
  4      1.0817087176           0.38865972362    
D   1
  1      0.53329136060          1.0000000        
D   1
  1      0.24984101827          1.0000000        
D   1
  1      0.10879770063          1.0000000        
F   1
  1      1.8893800000           1.0000000        
F   1
  1      0.79569000000          1.0000000        
F   1
  1      0.33510000000          1.0000000        
G   1
  1      1.2895000000           1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Tl
data:
THALLIUM
S   9
  1   9675.5500000              0.80000000000E-05      
  2   1471.4800000              0.57000000000E-04      
  3    323.64800000             0.22700000000E-03      
  4     33.807900000            0.21666000000E-01      
  5     21.131600000           -0.19589700000    
  6     13.209100000            0.67362000000    
  7      8.2561100000          -0.57167600000    
  8      5.1001400000          -0.61234400000    
  9      1.8194300000           0.75954400000    
S   3
  1     13.432924081            0.16050252545    
  2     11.126956705           -0.25827112953    
  3      2.0351129325           0.52570088358    
S   1
  1      0.96804610176          1.0000000        
S   1
  1      0.47288027019          1.0000000        
S   1
  1      0.21703241765          1.0000000        
S   1
  1      0.99551664344E-01            1.0000000        
S   1
  1      0.44674475181E-01            1.0000000        
S   1
  1      0.18183458197E-01            1.0000000        
P   7
  1     42.524000000            0.16050000000E-02      
  2     21.395700000           -0.23159000000E-01      
  3     13.373700000            0.11173800000    
  4      6.6133700000          -0.34647200000    
  5      2.0421700000           0.47507300000    
  6      1.1144900000           0.48633500000    
  7      0.59800600000          0.20513900000    
P   3
  1      9.0557032031          -0.57376712693E-01      
  2      3.9424773914           0.27305802340    
  3      1.2382159385           0.72255078460    
P   1
  1      0.29943260745          1.0000000        
P   1
  1      0.14250182360          1.0000000        
P   1
  1      0.61655072518E-01            1.0000000        
P   1
  1      0.26054870511E-01            1.0000000        
D   7
  1     63.792149375            0.19539028558E-03      
  2     10.854099697            0.17775848298E-01      
  3      6.3885280565          -0.89213657526E-01      
  4      2.4120875010           0.18424406191    
  5      1.4246170706           0.30659722011    
  6      0.83496548780          0.31018961556    
  7      0.48634320397          0.23215648111    
D   1
  1      0.27592111650          1.0000000        
D   1
  1      0.14737244064          1.0000000        
D   1
  1      0.67700000000E-01            1.0000000        
D   1
  1      0.25846985048E-01            1.0000000        
F   1
  1      0.42630000000          1.0000000        
F   1
  1      0.16900000000          1.0000000        
F   1
  1      1.0848100000           1.0000000        
F   1
  1      2.3083704534           1.0000000        
G   1
  1      0.36930000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Pb
data:
LEAD
S   9
  1   9368.3300000              0.14000000000E-04      
  2   1366.9300000              0.10300000000E-03      
  3    299.68200000             0.37900000000E-03      
  4     34.859700000            0.23274000000E-01      
  5     21.788900000           -0.20343600000    
  6     13.620000000            0.69921400000    
  7      8.5129500000          -0.60684100000    
  8      5.3033200000          -0.61139200000    
  9      1.9281600000           0.76522700000    
S   3
  1     13.559944213            0.15955164155    
  2     11.039620045           -0.26750615828    
  3      2.1371722788           0.52500552105    
S   1
  1      1.0373400312           1.0000000        
S   1
  1      0.51111685694          1.0000000        
S   1
  1      0.24673987563          1.0000000        
S   1
  1      0.11577976738          1.0000000        
S   1
  1      0.52874167812E-01            1.0000000        
S   1
  1      0.23675714798E-01            1.0000000        
P   7
  1     59.090100000            0.71600000000E-03      
  2     20.919700000           -0.21082000000E-01      
  3     13.077700000            0.12706100000    
  4      6.8991000000          -0.37228400000    
  5      2.1962700000           0.43566300000    
  6      1.3048600000           0.43573500000    
  7      0.77957200000          0.26094700000    
P   3
  1      9.1373183134          -0.55319030476E-01      
  2      3.9570574249           0.27275707058    
  3      1.2246639098           0.72280340692    
P   1
  1      0.42601564238          1.0000000        
P   1
  1      0.20378586294          1.0000000        
P   1
  1      0.88168647885E-01            1.0000000        
P   1
  1      0.37094701422E-01            1.0000000        
D   7
  1     66.348248961            0.28507140251E-03      
  2     13.455899798            0.93352787747E-02      
  3      6.5510273149          -0.75354763534E-01      
  4      2.6574136949           0.16674578725    
  5      1.6001278005           0.31208757936    
  6      0.93304454981          0.32900401823    
  7      0.54391365526          0.22655044022    
D   1
  1      0.32059545270          1.0000000        
D   1
  1      0.17922304239          1.0000000        
D   1
  1      0.83200000000E-01            1.0000000        
D   1
  1      0.33713194518E-01            1.0000000        
F   1
  1      0.44130000000          1.0000000        
F   1
  1      0.17820000000          1.0000000        
F   1
  1      1.1606000000           1.0000000        
F   1
  1      2.5184938758           1.0000000        
G   1
  1      0.38810000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Bi
data:
BISMUTH
S   9
  1   8131.0900000              0.29000000000E-04      
  2   1225.7700000              0.20000000000E-03      
  3    274.67200000             0.68400000000E-03      
  4     37.616400000            0.20218000000E-01      
  5     23.480400000           -0.15932600000    
  6     14.106500000            0.61172600000    
  7      8.8130500000          -0.54465300000    
  8      5.5077800000          -0.63688400000    
  9      2.0397700000           0.77169800000    
S   3
  1     13.614284474            0.15800789319    
  2     11.010881766           -0.27164962692    
  3      2.2630089550           0.52469330212    
S   1
  1      1.0975227257           1.0000000        
S   1
  1      0.52344449532          1.0000000        
S   1
  1      0.26734409206          1.0000000        
S   1
  1      0.12836608814          1.0000000        
S   1
  1      0.60097735551E-01            1.0000000        
S   1
  1      0.28937639233E-01            1.0000000        
P   7
  1     99.591400000            0.34600000000E-03      
  2     19.896400000           -0.19976000000E-01      
  3     12.437600000            0.17544600000    
  4      7.7740000000          -0.37955600000    
  5      4.8399500000          -0.55262000000E-01      
  6      2.2547800000           0.52888400000    
  7      1.1804900000           0.52132400000    
P   3
  1      9.6213214965          -0.52920356623E-01      
  2      4.1321350830           0.26705180214    
  3      1.2785827783           0.72824686940    
P   1
  1      0.59423596262          1.0000000        
P   1
  1      0.25794168858          1.0000000        
P   1
  1      0.11273595358          1.0000000        
P   1
  1      0.47791974731E-01            1.0000000        
D   7
  1     69.632799181            0.35055800732E-03      
  2     14.888614968            0.81591735697E-02      
  3      6.5949628713          -0.83905319526E-01      
  4      4.1796107640           0.28034212952E-01      
  5      2.5697950152           0.20202314185    
  6      1.5601364822           0.33621249652    
  7      0.89210528768          0.34629017140    
D   1
  1      0.48093728228          1.0000000        
D   1
  1      0.24233621968          1.0000000        
D   1
  1      0.10440000000          1.0000000        
D   1
  1      0.42820432734E-01            1.0000000        
F   1
  1      0.48030000000          1.0000000        
F   1
  1      0.20060000000          1.0000000        
F   1
  1      1.2625600000           1.0000000        
F   1
  1      2.7210175470           1.0000000        
G   1
  1      0.42030000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Po
data:
POLONIUM
S   9
  1   8913.2900000              0.47000000000E-04      
  2   1338.9800000              0.33100000000E-03      
  3    299.53800000             0.11610000000E-02      
  4     51.148900000            0.78990000000E-02      
  5     23.015600000           -0.14934700000    
  6     14.376500000            0.63824200000    
  7      8.9827900000          -0.61708300000    
  8      5.6129200000          -0.60519700000    
  9      2.1648400000           0.77608600000    
S   3
  1     14.787766907            0.15929033129    
  2     11.958781204           -0.27310166985    
  3      2.4798455066           0.52423698726    
S   1
  1      1.1753800000           1.0000000        
S   1
  1      0.55481477792          1.0000000        
S   1
  1      0.28581735198          1.0000000        
S   1
  1      0.13849439468          1.0000000        
S   1
  1      0.64954523837E-01            1.0000000        
S   1
  1      0.29031304745E-01            1.0000000        
P   7
  1    113.55700000             0.38700000000E-03      
  2     20.363900000           -0.18255000000E-01      
  3     12.727400000            0.17477600000    
  4      7.9498400000          -0.39870300000    
  5      4.9647700000          -0.31812000000E-01      
  6      2.3013000000           0.56604700000    
  7      1.1954500000           0.51022200000    
P   3
  1      8.4681300000          -0.23853762000    
  2      7.7962017000           0.28579119000    
  3      0.66871758000          0.46050656000    
P   1
  1      0.59152423927          1.0000000        
P   1
  1      0.24444843795          1.0000000        
P   1
  1      0.11018922460          1.0000000        
P   1
  1      0.48149776000E-01            1.0000000        
P   1
  1      0.16630967796E-01            1.0000000        
D   7
  1     73.649818245            0.43310334586E-03      
  2     16.743441686            0.69436968591E-02      
  3      5.8163048812          -0.83799240387    
  4      5.6493757173           0.79372183416    
  5      2.4547686106           0.29055549251    
  6      1.3909015593           0.38177920670    
  7      0.78934505572          0.29342954208    
D   1
  1      0.44107648549          1.0000000        
D   1
  1      0.23631248810          1.0000000        
D   1
  1      0.10930000000          1.0000000        
D   1
  1      0.43600758103E-01            1.0000000        
F   1
  1      0.48940000000          1.0000000        
F   1
  1      0.20020000000          1.0000000        
F   1
  1      1.3122000000           1.0000000        
F   1
  1      2.8220658714           1.0000000        
G   1
  1      0.40740000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: At
data:
ASTATINE
S   9
  1   9090.2800000              0.35000000000E-04      
  2   1373.0700000              0.24200000000E-03      
  3    307.95000000             0.81500000000E-03      
  4     48.017600000            0.84650000000E-02      
  5     23.909900000           -0.14733300000    
  6     14.933400000            0.63241500000    
  7      9.3317100000          -0.61640600000    
  8      5.8320600000          -0.61925800000    
  9      2.2878700000           0.78512400000    
S   3
  1     14.805780876            0.15771473639    
  2     11.855783628           -0.28007490839    
  3      2.5818782360           0.52359428906    
S   1
  1      1.2537238008           1.0000000        
S   1
  1      0.61460691976          1.0000000        
S   1
  1      0.31486716636          1.0000000        
S   1
  1      0.15441669153          1.0000000        
S   1
  1      0.72866424566E-01            1.0000000        
S   1
  1      0.33450798374E-01            1.0000000        
P   7
  1    124.60200000             0.46800000000E-03      
  2     20.889900000           -0.16124000000E-01      
  3     13.058500000            0.17119600000    
  4      8.1606100000          -0.40887500000    
  5      5.0980800000          -0.16407000000E-01      
  6      2.3787600000           0.58817200000    
  7      1.2375500000           0.50099700000    
P   3
  1      8.7977584321          -0.23832810213    
  2      8.0996431502           0.28585830834    
  3      0.67629719775          0.46050935965    
P   1
  1      0.60785017930          1.0000000        
P   1
  1      0.26116561417          1.0000000        
P   1
  1      0.11948611257          1.0000000        
P   1
  1      0.52899086095E-01            1.0000000        
P   1
  1      0.15692454478E-01            1.0000000        
D   7
  1     76.152584155            0.54645145370E-03      
  2     17.982092186            0.70498116717E-02      
  3      5.8900316564          -0.59711331046    
  4      5.6001503121           0.56517203927    
  5      2.4782622062           0.32344318344    
  6      1.3928750256           0.39511263456    
  7      0.78560551382          0.27094838862    
D   1
  1      0.44173978741          1.0000000        
D   1
  1      0.24984733563          1.0000000        
D   1
  1      0.12700000000          1.0000000        
D   1
  1      0.50459262594E-01            1.0000000        
F   1
  1      0.53890000000          1.0000000        
F   1
  1      0.22870000000          1.0000000        
F   1
  1      1.4237200000           1.0000000        
F   1
  1      3.0086421207           1.0000000        
G   1
  1      0.43630000000          1.0000000        


name: Def2-QZVPD
description: def2-QZVPD Quadruple-Zeta-Valence basis set + Polarization + Diffuse basis functions
elt: Rn
data:
RADON
S   9
  1  12715.6000000              0.47000000000E-04      
  2   1913.3000000              0.33800000000E-03      
  3    429.95600000             0.12800000000E-02      
  4    100.97800000             0.27820000000E-02      
  5     24.470800000           -0.10042100000    
  6     15.292200000            0.53982400000    
  7      9.5548300000          -0.57385600000    
  8      5.9666100000          -0.61000000000    
  9      2.3893900000           0.79325300000    
S   3
  1     17.195195341            0.16333005101    
  2     14.230303720           -0.27167744770    
  3      3.0760339153           0.52372666490    
S   1
  1      1.3276477516           1.0000000        
S   1
  1      0.69973866760          1.0000000        
S   1
  1      0.33174234887          1.0000000        
S   1
  1      0.16093431878          1.0000000        
S   1
  1      0.75883596172E-01            1.0000000        
S   1
  1      0.36702167935E-01            1.0000000        
P   7
  1    131.70800000             0.58500000000E-03      
  2     21.401600000           -0.14438000000E-01      
  3     13.382600000            0.17009500000    
  4      8.3688000000          -0.42250400000    
  5      5.2294500000          -0.17190000000E-02      
  6      2.4768500000           0.60115800000    
  7      1.3018000000           0.49278000000    
P   3
  1      9.0768547920          -0.23950411879    
  2      8.3822367043           0.28554010268    
  3      0.70618692299          0.46017587936    
P   1
  1      0.64553860374          1.0000000        
P   1
  1      0.28380500916          1.0000000        
P   1
  1      0.13160518578          1.0000000        
P   1
  1      0.58958259826E-01            1.0000000        
P   1
  1      0.15768923099E-01            1.0000000        
D   8
  1    183.73000000             0.12900000000E-03      
  2     54.689700000            0.94900000000E-03      
  3     16.425500000            0.10100000000E-01      
  4      7.3050000000          -0.87309000000E-01      
  5      4.2747700000           0.71452000000E-01      
  6      2.6114200000           0.29537800000    
  7      1.5667400000           0.35873100000    
  8      0.96097900000          0.25612000000    
D   1
  1      0.59653500000          1.0000000        
D   1
  1      0.34202800000          1.0000000        
D   1
  1      0.15160000000          1.0000000        
D   1
  1      0.59685507179E-01            1.0000000        
F   1
  1      0.59400000000          1.0000000        
F   1
  1      0.26840000000          1.0000000        
F   1
  1      1.5556400000           1.0000000        
F   1
  1      3.2498641894           1.0000000        
G   1
  1      0.47630000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: Na
data:
SODIUM
S   10
  1 379852.2008100              0.20671384468E-04      
  2  56886.0063780              0.16070466617E-03      
  3  12942.7018380              0.84462905848E-03      
  4   3664.3017904              0.35519026029E-02      
  5   1194.7417499              0.12754034468E-01      
  6    430.98192917             0.39895462742E-01      
  7    167.83169424             0.10720154498    
  8     69.306669040            0.23339516913    
  9     29.951170886            0.36333077287    
 10     13.380791097            0.30544770974    
S   3
  1    121.74011283             0.36142427284E-01      
  2     37.044143387            0.28820961687    
  3     13.995422624            0.79337384869    
S   1
  1      5.9827797428           1.0000000        
S   1
  1      2.4830455118           1.0000000        
S   1
  1      1.0452506187           1.0000000        
S   1
  1      0.43875640383          1.0000000        
S   1
  1      0.65595633185E-01            1.0000000        
S   1
  1      0.30561925072E-01            1.0000000        
S   1
  1      0.15509064018E-01            1.0000000        
P   8
  1    690.77627017             0.37478518415E-03      
  2    163.82806121             0.31775441030E-02      
  3     52.876460769            0.16333581338E-01      
  4     19.812270493            0.59754902585E-01      
  5      8.1320378784           0.15879328812    
  6      3.4969068377           0.29049363260    
  7      1.5117244146           0.36368131139    
  8      0.64479294912          0.28195867334    
P   1
  1      0.26145823312          1.0000000        
P   1
  1      0.11704726116          1.0000000        
P   1
  1      0.40494747666E-01            1.0000000        
P   1
  1      0.15666707355E-01            1.0000000        
D   1
  1      5.3000000              1.0000000        
D   1
  1      1.5900000              1.0000000        
D   1
  1      0.2300000              1.0000000        
D   1
  1      0.0757000              1.0000000        
F   1
  1      4.2700000              1.0000000        
F   1
  1      0.1350000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Mg
data:
MAGNESIUM
S   10
  1 605967.7875300              0.14430176617E-04      
  2  90569.0946920              0.11249871807E-03      
  3  20574.2528440              0.59264972450E-03      
  4   5818.6284865              0.24988770424E-02      
  5   1895.6296075              0.90230775141E-02      
  6    683.45941021             0.28579919806E-01      
  7    266.18219762             0.79064453923E-01      
  8    110.11220010             0.18269337814    
  9     47.777041234            0.32157193967    
 10     21.542166149            0.35028259389    
S   3
  1    174.12136378             0.22931111278E-01      
  2     53.484972498            0.19151777552    
  3     20.500213307            0.61155711055    
S   1
  1      9.8056826922           1.0000000        
S   1
  1      3.5402989348           1.0000000        
S   1
  1      1.5450850046           1.0000000        
S   1
  1      0.66540195432          1.0000000        
S   1
  1      0.14355439071          1.0000000        
S   1
  1      0.66624673468E-01            1.0000000        
S   1
  1      0.29772648266E-01            1.0000000        
P   8
  1    893.20460829             0.34958267428E-03      
  2    211.78258286             0.29811890111E-02      
  3     68.443200537            0.15517845758E-01      
  4     25.727265349            0.57578659557E-01      
  5     10.606634281            0.15610307853    
  6      4.5934126484           0.29230912580    
  7      2.0100469807           0.37219024072    
  8      0.87384841536          0.27578088891    
P   1
  1      0.35615076666          1.0000000        
P   1
  1      0.18995954356          1.0000000        
P   1
  1      0.74580135669E-01            1.0000000        
P   1
  1      0.29221641309E-01            1.0000000        
D   1
  1      6.9300000              1.0000000        
D   1
  1      2.1000000              1.0000000        
D   1
  1      0.6500000              1.0000000        
D   1
  1      0.2000000              1.0000000        
D   1
  1      0.0520000              1.0000000        
F   1
  1      5.6000000              1.0000000        
F   1
  1      0.1600000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: K
data:
POTASSIUM
S   11
  1 2022075.1391000             0.10144874011E-04      
  2 303044.6556800              0.78783500963E-04      
  3  69013.9384900              0.41380919674E-03      
  4  19559.2446150              0.17427571893E-02      
  5   6383.8934901              0.63004086126E-02      
  6   2305.3502858              0.20125347032E-01      
  7    899.14418101             0.56966060520E-01      
  8    372.59500133             0.13882654093    
  9    161.97635247             0.27132285414    
 10     73.085553853            0.36383620662    
 11     33.595644762            0.24724464776    
S   4
  1    685.49855365             0.44367463797E-02      
  2    211.66163373             0.42502718169E-01      
  3     80.851405131            0.18467742018    
  4     35.108667236            0.29353173891    
S   1
  1     14.409437283            1.0000000        
S   1
  1      6.8697147262           1.0000000        
S   1
  1      3.2121883687           1.0000000        
S   1
  1      1.2610484365           1.0000000        
S   1
  1      0.61438946301          1.0000000        
S   1
  1      0.27264370973          1.0000000        
S   1
  1      0.77173005207E-01            1.0000000        
S   1
  1      0.40918397569E-01            1.0000000        
S   1
  1      0.17055762425E-01            1.0000000        
P   9
  1   3469.6649718              0.21340225970E-03      
  2    822.02356107             0.18637844836E-02      
  3    266.58406636             0.10211431546E-01      
  4    101.28048161             0.40799604728E-01      
  5     42.429490761            0.12257473393    
  6     18.912083912            0.26405833679    
  7      8.7017779030           0.38227164575    
  8      4.0854567599           0.29998812383    
  9      1.8667286060           0.78007265591E-01      
P   5
  1     27.544639057           -0.58222994163E-02      
  2      9.2098893609          -0.26787531329E-01      
  3      1.7232877425           0.30666847665    
  4      0.77969303735          0.66927944165    
  5      0.34379047862          0.60376468615    
P   1
  1      0.14346681918          1.0000000        
P   1
  1      0.68000000000E-01            1.0000000        
P   1
  1      0.32000000000E-01            1.0000000        
P   1
  1      0.15300000000E-01            1.0000000        
D   1
  1      1.7000000              1.0000000        
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1800000              1.0000000        
D   1
  1      0.0540000              1.0000000        
F   1
  1      2.3700000              1.0000000        
F   1
  1      0.7900000              1.0000000        
F   1
  1      0.0900000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ca
data:
CALCIUM
S   11
  1 2433075.4304000             0.91625196182E-05      
  2 364160.4301500              0.71271617974E-04      
  3  82898.7476370              0.37433706369E-03      
  4  23499.7305400              0.15762862250E-02      
  5   7671.2245985              0.57026102580E-02      
  6   2770.2330687              0.18255738108E-01      
  7   1080.6807550              0.51906421035E-01      
  8    448.04894531             0.12791238579    
  9    194.92007727             0.25586635231    
 10     88.039793338            0.36028678275    
 11     40.645696719            0.26838462020    
S   4
  1    779.53331918            -0.18403005509E-01      
  2    241.18856300            -0.17649440544    
  3     92.403869324           -0.77662799584    
  4     39.786090342           -1.3352155444     
S   1
  1     18.195864278            1.0000000        
S   1
  1      8.3321457067           1.0000000        
S   1
  1      3.9190196209           1.0000000        
S   1
  1      1.6667099493           1.0000000        
S   1
  1      0.80891084908          1.0000000        
S   1
  1      0.36174199934          1.0000000        
S   1
  1      0.82379874526E-01            1.0000000        
S   1
  1      0.47947864375E-01            1.0000000        
S   1
  1      0.22308112408E-01            1.0000000        
P   9
  1   4064.2232796              0.19780891021E-03      
  2    962.91550624             0.17307465902E-02      
  3    312.34501046             0.95298721105E-02      
  4    118.76056036             0.38387459783E-01      
  5     49.816153133            0.11679256218    
  6     22.259679401            0.25637225097    
  7     10.286094124            0.37986193747    
  8      4.8606982416           0.30805760637    
  9      2.2525682942           0.85755999942E-01      
P   5
  1     31.467555443           -0.42441487483E-02      
  2     10.657589056           -0.19579425947E-01      
  3      2.0505555426           0.21237507422    
  4      0.94362089228          0.46277871121    
  5      0.42709067504          0.39177495728    
P   1
  1      0.17788187209          1.0000000        
P   1
  1      0.86000000000E-01            1.0000000        
P   1
  1      0.41500000000E-01            1.0000000        
P   1
  1      0.20000000000E-01            1.0000000        
D   3
  1     16.924012098            0.35543971560E-01      
  2      4.4655403330           0.18133698335    
  3      1.4347576200           0.48002060116    
D   1
  1      0.46552376784          1.0000000        
D   1
  1      0.14097711082          1.0000000        
D   1
  1      0.41467009281E-01            1.0000000        
F   1
  1      2.6500000000           1.0000000        
F   1
  1      0.7940000000           1.0000000        
F   1
  1      0.1300000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Sc
data:
SCANDIUM
S   11
  1 2855231.1264000             0.84862794535E-05      
  2 427433.3422100              0.65998092974E-04      
  3  97233.2185450              0.34740968058E-03      
  4  27496.2228460              0.14694099525E-02      
  5   8948.7324409              0.53410667286E-02      
  6   3221.0397292              0.17200652511E-01      
  7   1252.0534077              0.49287065332E-01      
  8    517.26093376             0.12273534550    
  9    224.33127242             0.24910183844    
 10    101.10551671             0.35884366997    
 11     46.684957855            0.27782811319    
S   4
  1    947.75965484             0.36123019249E-02      
  2    293.07262846             0.35616224567E-01      
  3    111.70230657             0.16664064248    
  4     47.756215212            0.32531051399    
S   1
  1     21.121984009            1.0000000        
S   1
  1      9.7765922198           1.0000000        
S   1
  1      4.5982699340           1.0000000        
S   1
  1      1.9928487767           1.0000000        
S   1
  1      0.95939954457          1.0000000        
S   1
  1      0.42566790070          1.0000000        
S   1
  1      0.98132196006E-01            1.0000000        
S   1
  1      0.56894222237E-01            1.0000000        
S   1
  1      0.25369907195E-01            1.0000000        
P   9
  1   4611.4680242              0.19180655992E-03      
  2   1092.4666458              0.16801897753E-02      
  3    354.41923265             0.92763338425E-02      
  4    134.83390286             0.37537202735E-01      
  5     56.610873926            0.11493045217    
  6     25.336605518            0.25446811084    
  7     11.741313238            0.37993352765    
  8      5.5697268625           0.30948776388    
  9      2.5949954062           0.86972259257E-01      
P   5
  1     35.951198081           -0.55780446917E-02      
  2     12.301020232           -0.25933825208E-01      
  3      2.3876557755           0.27489094204    
  4      1.1031823600           0.59208047142    
  5      0.50008479496          0.49113471853    
P   1
  1      0.20796508799          1.0000000        
P   1
  1      0.10100000000          1.0000000        
P   1
  1      0.48000000000E-01            1.0000000        
P   1
  1      0.23000000000E-01            1.0000000        
D   5
  1     73.531179748            0.22506354976E-02      
  2     21.764759639            0.16377610133E-01      
  3      7.9233701690           0.63330446952E-01      
  4      3.1847889778           0.17056208548    
  5      1.3427790019           0.30119020299    
D   1
  1      0.56149574983          1.0000000        
D   1
  1      0.22764073650          1.0000000        
D   1
  1      0.85211221793E-01            1.0000000        
D   1
  1      0.35E-01               1.0000000        
F   1
  1      1.4810000              1.0000000        
F   1
  1      0.3450000              1.0000000        
F   1
  1      0.1100000              1.0000000        
G   1
  1      0.5310000              1.0000000        
G   1
  1      0.1330000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ti
data:
TITANIUM
S   11
  1 3070548.8651000             0.86954016630E-05      
  2 460777.8864300              0.67452737727E-04      
  3 104901.2288900              0.35477293028E-03      
  4  29695.8611990              0.14977525588E-02      
  5   9678.8892688              0.54309912055E-02      
  6   3490.1877912              0.17439360524E-01      
  7   1359.2217621              0.49835634640E-01      
  8    562.42721208             0.12379633943    
  9    244.22296250             0.25057490943    
 10    110.16668710             0.35934609007    
 11     50.881903357            0.27594242664    
S   4
  1    965.95430789             0.41773927781E-02      
  2    299.27072059             0.40277148567E-01      
  3    114.83772939             0.17898686817    
  4     49.477578954            0.31783043543    
S   1
  1     22.982839977            1.0000000        
S   1
  1     10.518305037            1.0000000        
S   1
  1      4.9774390567           1.0000000        
S   1
  1      2.1339846838           1.0000000        
S   1
  1      1.0342457284           1.0000000        
S   1
  1      0.46199774995          1.0000000        
S   1
  1      0.10621264194          1.0000000        
S   1
  1      0.54340347374E-01            1.0000000        
S   1
  1      0.25110217385E-01            1.0000000        
P   9
  1   5169.6755427              0.18802523596E-03      
  2   1225.0961638              0.16473458826E-02      
  3    397.60051934             0.91104554321E-02      
  4    151.36154684             0.36987450926E-01      
  5     63.613321773            0.11376329624    
  6     28.514560307            0.25345208574    
  7     13.248003298            0.38019402704    
  8      6.3048807760           0.30989136346    
  9      2.9493525821           0.87418944007E-01      
P   5
  1     40.738772213           -0.73233793267E-02      
  2     14.062358461           -0.34282591082E-01      
  3      2.7460680961           0.35655009250    
  4      1.2713688141           0.76112035427    
  5      0.57610015545          0.62716743237    
P   1
  1      0.23981820724          1.0000000        
P   1
  1      0.11000000000          1.0000000        
P   1
  1      0.50000000000E-01            1.0000000        
P   1
  1      0.23000000000E-01            1.0000000        
D   5
  1     89.589880075            0.21223030030E-02      
  2     26.591412960            0.15911819913E-01      
  3      9.7739715702           0.62875243121E-01      
  4      3.9625083655           0.17144170807    
  5      1.6890532654           0.30565506624    
D   1
  1      0.71539771469          1.0000000        
D   1
  1      0.29366677748          1.0000000        
D   1
  1      0.11079094851          1.0000000        
D   1
  1      0.45E-01               1.0000000        
F   1
  1      2.0930000              1.0000000        
F   1
  1      0.5620000              1.0000000        
F   1
  1      0.1910000              1.0000000        
G   1
  1      1.0040000              1.0000000        
G   1
  1      0.2680000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: V
data:
VANADIUM
S   11
  1 3360380.0382000             0.87027840678E-05      
  2 502646.7317800              0.67786024965E-04      
  3 114247.2286700              0.35699229090E-03      
  4  32321.9726300              0.15075507352E-02      
  5  10532.9472710              0.54664377528E-02      
  6   3798.3004439              0.17547310839E-01      
  7   1479.6094715              0.50106594778E-01      
  8    612.57405507             0.12431296066    
  9    266.22103326             0.25117026883    
 10    120.21980126             0.35926015903    
 11     55.591180848            0.27505075685    
S   4
  1   1082.4768635              0.39326847695E-02      
  2    334.94462061             0.38298477998E-01      
  3    128.31559026             0.17259908827    
  4     55.311589616            0.31287423870    
S   1
  1     25.108383036            1.0000000        
S   1
  1     11.667553242            1.0000000        
S   1
  1      5.5372073270           1.0000000        
S   1
  1      2.3781007618           1.0000000        
S   1
  1      1.1506947329           1.0000000        
S   1
  1      0.51283991040          1.0000000        
S   1
  1      0.11625711449          1.0000000        
S   1
  1      0.58272785598E-01            1.0000000        
S   1
  1      0.26662312245E-01            1.0000000        
P   9
  1   5782.8035005              0.18344743045E-03      
  2   1369.9392282              0.16095217453E-02      
  3    444.53147129             0.89242268749E-02      
  4    169.25617556             0.36375182379E-01      
  5     71.168730031            0.11246803294    
  6     31.933358374            0.25226107794    
  7     14.865336779            0.38039695005    
  8      7.0921740091           0.31068797325    
  9      3.3281157846           0.88141200458E-01      
P   5
  1     45.842906017           -0.56661391945E-02      
  2     15.940339016           -0.26718979445E-01      
  3      3.1257155025           0.27354632707    
  4      1.4485867558           0.57972883053    
  5      0.65577902825          0.47601110515    
P   1
  1      0.27311626644          1.0000000        
P   1
  1      0.12200000000          1.0000000        
P   1
  1      0.55000000000E-01            1.0000000        
P   1
  1      0.25000000000E-01            1.0000000        
D   5
  1    103.95047414             0.21007158819E-02      
  2     30.901688665            0.16015244877E-01      
  3     11.420321145            0.64127456940E-01      
  4      4.6573272292           0.17488905695    
  5      1.9963682623           0.31003778048    
D   1
  1      0.84967249531          1.0000000        
D   1
  1      0.34953221876          1.0000000        
D   1
  1      0.13165588233          1.0000000        
D   1
  1      0.52E-01               1.0000000        
F   1
  1      2.9330000              1.0000000        
F   1
  1      0.8310000              1.0000000        
F   1
  1      0.2570000              1.0000000        
G   1
  1      1.8560000              1.0000000        
G   1
  1      0.4550000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Cr
data:
CHROMIUM
S   11
  1 3637838.6820000             0.87693297699E-05      
  2 544864.4610000              0.68169050223E-04      
  3 123997.5507900              0.35844590272E-03      
  4  35116.7331660              0.15117006948E-02      
  5  11455.7022980              0.54731929774E-02      
  6   4135.9906712              0.17539430107E-01      
  7   1613.2513581              0.50004870927E-01      
  8    668.77932380             0.12393518958    
  9    291.01365155             0.25039606407    
 10    131.57328167             0.35870470429    
 11     60.924567928            0.27581148880    
S   4
  1   1196.2899601              0.77368642037E-02      
  2    369.76947592             0.75837835399E-01      
  3    141.54426084             0.34435148637    
  4     60.999228765            0.63249297923    
S   1
  1     27.599113358            1.0000000        
S   1
  1     12.882112056            1.0000000        
S   1
  1      6.1247513721           1.0000000        
S   1
  1      2.6332895309           1.0000000        
S   1
  1      1.2708482289           1.0000000        
S   1
  1      0.56483575923          1.0000000        
S   1
  1      0.12596808943          1.0000000        
S   1
  1      0.62045607277E-01            1.0000000        
S   1
  1      0.28144312720E-01            1.0000000        
P   9
  1   6395.8781792              0.18104788151E-03      
  2   1515.1701574              0.15893658935E-02      
  3    491.70538681             0.88258739429E-02      
  4    187.28416675             0.36068946983E-01      
  5     78.800346444            0.11189649648    
  6     35.396291693            0.25202239843    
  7     16.509278879            0.38082266430    
  8      7.8947396863           0.31035222437    
  9      3.7136414465           0.87980310362E-01      
P   5
  1     51.259312534           -0.60542038165E-02      
  2     17.934932523           -0.28761764001E-01      
  3      3.5257174218           0.29087768170    
  4      1.6339163906           0.61267525056    
  5      0.73852413834          0.50126035018    
P   1
  1      0.30752368193          1.0000000        
P   1
  1      0.13500000000          1.0000000        
P   1
  1      0.59000000000E-01            1.0000000        
P   1
  1      0.26000000000E-01            1.0000000        
D   5
  1    118.24986288             0.21012757435E-02      
  2     35.193935700            0.16212269500E-01      
  3     13.057816022            0.65581852668E-01      
  4      5.3485602844           0.17849601449    
  5      2.3004233713           0.31376763016    
D   1
  1      0.98114328305          1.0000000        
D   1
  1      0.40334183206          1.0000000        
D   1
  1      0.15135589551          1.0000000        
D   1
  1      0.60E-01               1.0000000        
F   1
  1      3.7330000              1.0000000        
F   1
  1      1.1470000              1.0000000        
F   1
  1      0.3660000              1.0000000        
G   1
  1      2.6570000              1.0000000        
G   1
  1      0.7190000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Mn
data:
MANGANESE
S   11
  1 4289357.6441000             0.79360554972E-05      
  2 636361.0028500              0.62542986761E-04      
  3 143637.2756900              0.33226388724E-03      
  4  40406.3454320              0.14130009568E-02      
  5  13104.3634170              0.51560918319E-02      
  6   4705.0664255              0.16659574919E-01      
  7   1825.7125432              0.47908083403E-01      
  8    753.33816229             0.11994903752    
  9    326.47253285             0.24550296959    
 10    147.10300670             0.35822739571    
 11     67.987226869            0.28295764442    
S   4
  1   1300.7266717              0.76025154141E-02      
  2    402.72027544             0.74365109808E-01      
  3    154.38971348             0.33780474819    
  4     66.443384613            0.62779331746    
S   1
  1     30.975316006            1.0000000        
S   1
  1     14.222980890            1.0000000        
S   1
  1      6.7598265074           1.0000000        
S   1
  1      2.9087083287           1.0000000        
S   1
  1      1.3966507792           1.0000000        
S   1
  1      0.61792624091          1.0000000        
S   1
  1      0.13439483715          1.0000000        
S   1
  1      0.65195053803E-01            1.0000000        
S   1
  1      0.29415713624E-01            1.0000000        
P   9
  1   6483.2629658              0.20479778890E-03      
  2   1556.7134859              0.17525750185E-02      
  3    509.73925460             0.95798802458E-02      
  4    195.28408089             0.38681362983E-01      
  5     82.542547525            0.11832401588    
  6     37.212076731            0.26168459627    
  7     17.425804462            0.38400628821    
  8      8.3691376962           0.29704166759    
  9      3.9409000444           0.78263290323E-01      
P   5
  1     57.202741010           -0.47749099800E-02      
  2     20.090935947           -0.22989729915E-01      
  3      3.9357553763           0.23197065881    
  4      1.8181984012           0.48435204043    
  5      0.81881535281          0.39159479004    
P   1
  1      0.34038359193          1.0000000        
P   1
  1      0.15000000000          1.0000000        
P   1
  1      0.63000000000E-01            1.0000000        
P   1
  1      0.27000000000E-01            1.0000000        
D   6
  1    200.40254535             0.89549560240E-03      
  2     59.898225773            0.76257630942E-02      
  3     22.810570167            0.34523224226E-01      
  4      9.5874142097           0.10552676975    
  5      4.2933710910           0.22575377683    
  6      1.9537618373           0.32766533667    
D   1
  1      0.87378873598          1.0000000        
D   1
  1      0.37597748904          1.0000000        
D   1
  1      0.14811547592          1.0000000        
D   1
  1      0.60E-01               1.0000000        
F   1
  1      4.3530000              1.0000000        
F   1
  1      1.3260000              1.0000000        
F   1
  1      0.4080000              1.0000000        
F   1
  1      0.1255000              1.0000000        
G   1
  1      3.3160000              1.0000000        
G   1
  1      0.9290000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Fe
data:
IRON
S   11
  1 4313154.4338000             0.86712290122E-05      
  2 645875.0825300              0.67423150519E-04      
  3 146981.8769800              0.35448747955E-03      
  4  41630.6150440              0.14948285557E-02      
  5  13580.6201090              0.54136698440E-02      
  6   4902.0620613              0.17362460824E-01      
  7   1911.2900837              0.49566574059E-01      
  8    791.99837852             0.12309089705    
  9    344.54799181             0.24936705764    
 10    155.78722730             0.35858414677    
 11     72.179380315            0.27738221642    
S   4
  1   1417.9125091              0.74871631942E-02      
  2    439.23184195             0.73337584435E-01      
  3    168.51006820             0.33383143870    
  4     72.776269412            0.62022524641    
S   1
  1     32.752961774            1.0000000        
S   1
  1     15.434336101            1.0000000        
S   1
  1      7.3639318205           1.0000000        
S   1
  1      3.1698832880           1.0000000        
S   1
  1      1.5243708395           1.0000000        
S   1
  1      0.67496281152          1.0000000        
S   1
  1      0.14718566032          1.0000000        
S   1
  1      0.70082216629E-01            1.0000000        
S   1
  1      0.31208269419E-01            1.0000000        
P   9
  1   7709.0587627              0.17711229843E-03      
  2   1826.4666323              0.15560056795E-02      
  3    592.84368362             0.86629536960E-02      
  4    225.93763245             0.35565954156E-01      
  5     95.164758890            0.11098847278    
  6     42.823132375            0.25177796624    
  7     20.036286581            0.38166911079    
  8      9.6159346283           0.30963598261    
  9      4.5393538787           0.87558276626E-01      
P   5
  1     62.997519003           -0.50910388724E-02      
  2     22.262748731           -0.24540463235E-01      
  3      4.3900064942           0.24345605487    
  4      2.0328913928           0.50781898425    
  5      0.91592621576          0.41214895672    
P   1
  1      0.38036653507          1.0000000        
P   1
  1      0.1600000              1.0000000        
P   1
  1      0.0670000              1.0000000        
P   1
  1      0.0280000              1.0000000        
D   6
  1    218.33430163             0.93700006628E-03      
  2     65.256292616            0.80008769378E-02      
  3     24.866944817            0.36305286587E-01      
  4     10.473399301            0.11057189871    
  5      4.6947005007           0.23219588596    
  6      2.1315982534           0.32922859685    
D   1
  1      0.94748004605          1.0000000        
D   1
  1      0.40346488831          1.0000000        
D   1
  1      0.15687414728          1.0000000        
D   1
  1      0.62E-01               1.0000000        
F   1
  1      5.1030000              1.0000000        
F   1
  1      1.5980000              1.0000000        
F   1
  1      0.5050000              1.0000000        
F   1
  1      0.1596000              1.0000000        
G   1
  1      3.9750000              1.0000000        
G   1
  1      1.1390000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Co
data:
COBALT
S   11
  1 4658206.5032000             0.86609506454E-05      
  2 697560.8745300              0.67336300186E-04      
  3 158759.8712400              0.35399044899E-03      
  4  44969.0993790              0.14926384309E-02      
  5  14670.7142470              0.54053095095E-02      
  6   5295.8947250              0.17335233605E-01      
  7   2065.0581167              0.49486641301E-01      
  8    855.90627750             0.12289351961    
  9    372.48747255             0.24903230028    
 10    168.50576608             0.35838320259    
 11     78.128761566            0.27777974150    
S   4
  1   1534.5149885              0.74464372833E-02      
  2    475.52976096             0.72993601986E-01      
  3    182.54836839             0.33243104986    
  4     78.916467177            0.61900490005    
S   1
  1     35.500865522            1.0000000        
S   1
  1     16.790414486            1.0000000        
S   1
  1      8.0240232510           1.0000000        
S   1
  1      3.4571682964           1.0000000        
S   1
  1      1.6599835391           1.0000000        
S   1
  1      0.73380022453          1.0000000        
S   1
  1      0.15878613103          1.0000000        
S   1
  1      0.74535659476E-01            1.0000000        
S   1
  1      0.32867351695E-01            1.0000000        
P   9
  1   8425.4331352              0.17491775490E-03      
  2   1995.8758452              0.15378901702E-02      
  3    647.76765681             0.85752453448E-02      
  4    246.88261214             0.35295266911E-01      
  5    104.00952246             0.11050007672    
  6     46.827478138            0.25160924538    
  7     21.934444535            0.38209003019    
  8     10.540499528            0.30947119879    
  9      4.9820419385           0.87436873012E-01      
P   5
  1     69.270787130           -0.61172424428E-02      
  2     24.583977935           -0.29655043898E-01      
  3      4.8562258878           0.29163333190    
  4      2.2480916102           0.60629408335    
  5      1.0114285977           0.49057440018    
P   1
  1      0.41919905455          1.0000000        
P   1
  1      0.1750000              1.0000000        
P   1
  1      0.0730000              1.0000000        
P   1
  1      0.0300000              1.0000000        
D   6
  1    237.58450966             0.97593282671E-03      
  2     71.086896302            0.83432571945E-02      
  3     27.119080683            0.37958471100E-01      
  4     11.448239054            0.11522936171    
  5      5.1391806672           0.23843467913    
  6      2.3323492099           0.33205699955    
D   1
  1      1.0338662062           1.0000000        
D   1
  1      0.43785146294          1.0000000        
D   1
  1      0.16895004948          1.0000000        
D   1
  1      0.66E-01               1.0000000        
F   1
  1      5.9750000              1.0000000        
F   1
  1      1.9030000              1.0000000        
F   1
  1      0.5940000              1.0000000        
F   1
  1      0.1854000              1.0000000        
G   1
  1      4.6350000              1.0000000        
G   1
  1      1.3490000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ni
data:
NICKEL
S   11
  1 5037649.9532000             0.86072778771E-05      
  2 754246.3941800              0.66935354750E-04      
  3 171644.1601000              0.35190801168E-03      
  4  48617.2302860              0.14839082715E-02      
  5  15860.9617950              0.53736344264E-02      
  6   5726.0018653              0.17233376287E-01      
  7   2232.9547317              0.49211476915E-01      
  8    925.49649101             0.12232504536    
  9    402.75336913             0.24829251588    
 10    182.19422856             0.35825476194    
 11     84.494109788            0.27881865553    
S   4
  1   1678.0564586              0.82462870895E-02      
  2    519.21358326             0.81505940361E-01      
  3    198.95881607             0.37495727651    
  4     85.901180703            0.70841743832    
S   1
  1     38.435760123            1.0000000        
S   1
  1     18.252349351            1.0000000        
S   1
  1      8.7283616939           1.0000000        
S   1
  1      3.7616245662           1.0000000        
S   1
  1      1.8028217338           1.0000000        
S   1
  1      0.79507140513          1.0000000        
S   1
  1      0.17031720284          1.0000000        
S   1
  1      0.78971236177E-01            1.0000000        
S   1
  1      0.34503486750E-01            1.0000000        
P   9
  1   9156.5701453              0.17346418360E-03      
  2   2169.0239526              0.15257220493E-02      
  3    703.98918991             0.85163281036E-02      
  4    268.36293215             0.35117466952E-01      
  5    113.10288796             0.11020275383    
  6     50.955539222            0.25162601670    
  7     23.896708209            0.38246389853    
  8     11.498241522            0.30907230267    
  9      5.4410908056           0.87194377415E-01      
P   5
  1     75.938560736           -0.74635546629E-02      
  2     27.037350184           -0.36453401627E-01      
  3      5.3404687432           0.35633549406    
  4      2.4700181361           0.73774121992    
  5      1.1095029064           0.59439383024    
P   1
  1      0.45899767101          1.0000000        
P   1
  1      0.1870000              1.0000000        
P   1
  1      0.0762000              1.0000000        
P   1
  1      0.0310000              1.0000000        
D   6
  1    258.11131142             0.23726274275E-02      
  2     77.254891371            0.20330132784E-01      
  3     29.500240033            0.92748486665E-01      
  4     12.477446945            0.28082284560    
  5      5.6070455111           0.57392657880    
  6      2.5427744163           0.78766058527    
D   1
  1      1.1238296774           1.0000000        
D   1
  1      0.47361171459          1.0000000        
D   1
  1      0.18161858319          1.0000000        
D   1
  1      0.71E-01               1.0000000        
F   1
  1      6.7580000              1.0000000        
F   1
  1      2.1740000              1.0000000        
F   1
  1      0.6810000              1.0000000        
F   1
  1      0.2130000              1.0000000        
G   1
  1      5.2940000              1.0000000        
G   1
  1      1.5580000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Cu
data:
COPPER
S   11
  1 5056467.8898000             0.93501916365E-05      
  2 759457.8383500              0.72323443222E-04      
  3 173524.8849700              0.37813833845E-03      
  4  49327.2599880              0.15870129862E-02      
  5  16144.1499300              0.57220685294E-02      
  6   5844.5964680              0.18268390048E-01      
  7   2284.6812739              0.51893720863E-01      
  8    948.88232514             0.12796192366    
  9    413.66215455             0.25629891036    
 10    187.38942059             0.36064416138    
 11     86.872771648            0.26833664660    
S   4
  1   1744.0598287              0.88587079141E-02      
  2    540.93295513             0.86522785813E-01      
  3    207.99736224             0.38932285258    
  4     90.475793036            0.69777199902    
S   1
  1     38.869687699            1.0000000        
S   1
  1     18.974829147            1.0000000        
S   1
  1      9.0953644635           1.0000000        
S   1
  1      3.8330020174           1.0000000        
S   1
  1      1.8198891499           1.0000000        
S   1
  1      0.79068098393          1.0000000        
S   1
  1      0.14914142106          1.0000000        
S   1
  1      0.72448090592E-01            1.0000000        
S   1
  1      0.30959925368E-01            1.0000000        
P   9
  1   9720.4614555              0.17828803512E-03      
  2   2302.7557452              0.15678108633E-02      
  3    747.48498314             0.87470094509E-02      
  4    285.00132623             0.36044549301E-01      
  5    120.15121609             0.11287209053    
  6     54.145261156            0.25647377341    
  7     25.406033563            0.38512918379    
  8     12.224331465            0.30316512356    
  9      5.7638720668           0.81677218969E-01      
P   5
  1     83.210837217           -0.63530359993E-02      
  2     29.694779129           -0.31383834666E-01      
  3      5.8248516206           0.30930039753    
  4      2.6746181180           0.63583925938    
  5      1.1841836775           0.50946045967    
P   1
  1      0.48043583535          1.0000000        
P   1
  1      0.1870000              1.0000000        
P   1
  1      0.0762000              1.0000000        
P   1
  1      0.0310000              1.0000000        
D   6
  1    249.54025080             0.12432881244E-02      
  2     74.683914534            0.10456901995E-01      
  3     28.392717116            0.46451241249E-01      
  4     11.955968430            0.13541359729    
  5      5.3210744624           0.25852899978    
  6      2.3661189459           0.33168127635    
D   1
  1      1.0131863994           1.0000000        
D   1
  1      0.40710035940          1.0000000        
D   1
  1      0.14742541032          1.0000000        
D   1
  1      0.71E-01               1.0000000        
F   1
  1      6.9620000              1.0000000        
F   1
  1      2.2330000              1.0000000        
F   1
  1      0.7040000              1.0000000        
F   1
  1      0.2400000              1.0000000        
G   1
  1      5.9530000              1.0000000        
G   1
  1      1.7680000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Zn
data:
ZINC
S   11
  1 5742307.1507000             0.86864381562E-05      
  2 861450.7879000              0.67364668570E-04      
  3 196346.0586600              0.35349715135E-03      
  4  55682.8707370              0.14884153943E-02      
  5  18183.9023940              0.53840916617E-02      
  6   6569.6448019              0.17252738209E-01      
  7   2563.5613276              0.49238679132E-01      
  8   1063.1147176              0.12235812174    
  9    462.89771078             0.24835390245    
 10    209.52821049             0.35830632832    
 11     97.240787991            0.27880259960    
S   4
  1   1929.2689992              0.83077002177E-02      
  2    598.07122307             0.81882590163E-01      
  3    229.69667336             0.37588060221    
  4     99.416819228            0.71067260445    
S   1
  1     44.241101421            1.0000000        
S   1
  1     21.194367113            1.0000000        
S   1
  1     10.158731597            1.0000000        
S   1
  1      4.3746176158           1.0000000        
S   1
  1      2.0901489071           1.0000000        
S   1
  1      0.91869136437          1.0000000        
S   1
  1      0.19278660606          1.0000000        
S   1
  1      0.87329915171E-01            1.0000000        
S   1
  1      0.37552217126E-01            1.0000000        
P   9
  1  10690.4451070              0.17142867222E-03      
  2   2532.3159340              0.15088012830E-02      
  3    821.94295003             0.84368777910E-02      
  4    313.42757800             0.34898103208E-01      
  5    132.18314247             0.10993617353    
  6     59.620554387            0.25207277070    
  7     28.019488868            0.38325657524    
  8     13.511704850            0.30787091255    
  9      6.4053711253           0.86411696761E-01      
P   5
  1     89.981131918           -0.96262847843E-02      
  2     32.241767106           -0.47509407258E-01      
  3      6.3809448581           0.45834100431    
  4      2.9477928353           0.94473799128    
  5      1.3200854955           0.75923464871    
P   1
  1      0.54424674445          1.0000000        
P   1
  1      0.25799971797          1.0000000        
P   1
  1      0.92863192359E-01            1.0000000        
P   1
  1      0.34059341410E-01            1.0000000        
D   6
  1    305.22298937             0.27359792434E-02      
  2     91.468273202            0.23585229776E-01      
  3     34.986985968            0.10858422440    
  4     14.849415187            0.32843594226    
  5      6.6858545707           0.66180235634    
  6      3.0309412620           0.89165339320    
D   1
  1      1.3355050671           1.0000000        
D   1
  1      0.55883176392          1.0000000        
D   1
  1      0.21180799287          1.0000000        
D   1
  1      0.83E-01               1.0000000        
F   1
  1      8.0200000              1.0000000        
F   1
  1      2.6140000              1.0000000        
F   1
  1      0.8360000              1.0000000        
F   1
  1      0.2673000              1.0000000        
G   1
  1      6.6130000              1.0000000        
G   1
  1      1.9780000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ga
data:
GALLIUM
S   11
  1 6623802.0274000             0.79091326051E-05      
  2 987904.0707500              0.61835727406E-04      
  3 224132.0589900              0.32636322451E-03      
  4  63315.1929430              0.13810365049E-02      
  5  20611.3127020              0.50153772104E-02      
  6   7429.1672482              0.16130936803E-01      
  7   2894.2071720              0.46240827188E-01      
  8   1198.9915786              0.11579099571    
  9    521.82003812             0.23834840794    
 10    236.27549237             0.35374255971    
 11    109.98395671             0.29055721918    
S   4
  1   2101.2587253              0.83039611523E-02      
  2    650.97022519             0.82254127688E-01      
  3    250.22438356             0.38021717478    
  4    108.17616625             0.74503594690    
S   1
  1     51.057486710            1.0000000        
S   1
  1     23.647474527            1.0000000        
S   1
  1     11.361701144            1.0000000        
S   1
  1      5.0178135897           1.0000000        
S   1
  1      2.4102674998           1.0000000        
S   1
  1      1.0741046685           1.0000000        
S   1
  1      0.25745075831          1.0000000        
S   1
  1      0.12175227548          1.0000000        
S   1
  1      0.52360599017E-01            1.0000000        
P   9
  1  14711.7504830              0.11130990649E-03      
  2   3482.1451716              0.98495921142E-03      
  3   1130.2186655              0.55854182058E-02      
  4    431.54093448             0.23682413047E-01      
  5    182.41723648             0.78211587173E-01      
  6     82.706753603            0.19503829929    
  7     39.228128772            0.34131988495    
  8     19.201979939            0.35718665135    
  9      9.5056966689           0.16395955052    
P   2
  1     92.615613022           -0.85848284169E-01      
  2     33.750148165           -0.39435019538    
P   4
  1      7.3482283015           0.37941606569    
  2      3.7813384844           0.71306291866    
  3      2.3145183128           0.43210001481    
  4      0.80346859715          0.25838122797    
P   1
  1      1.5423710087           1.0000000        
P   1
  1      0.32910239639          1.0000000        
P   1
  1      0.11834088831          1.0000000        
P   1
  1      0.41627877699E-01            1.0000000        
D   7
  1    363.49565218             0.87402299276E-03      
  2    109.01749589             0.76751934098E-02      
  3     41.866430715            0.36388975341E-01      
  4     17.879279894            0.11325183017    
  5      8.1201893671           0.23770881294    
  6      3.7360611356           0.33306060389    
  7      1.6826812549           0.33130613756    
D   1
  1      0.72655790500          1.0000000        
D   1
  1      0.28498585079          1.0000000        
D   1
  1      0.1120000              1.0000000        
F   1
  1      7.7947037670           1.0000000        
F   1
  1      2.2956705920           1.0000000        
F   1
  1      0.18100000000          1.0000000        
F   1
  1      0.47100000000          1.0000000        
G   1
  1      0.40320000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ge
data:
GERMANIUM
S   11
  1 7233056.0346000             0.76638751457E-05      
  2 1082886.1731000             0.59603601369E-04      
  3 246481.4695900              0.31319088031E-03      
  4  69862.4269550              0.13194051561E-02      
  5  22815.8096620              0.47736099191E-02      
  6   8246.5369297              0.15319250467E-01      
  7   3219.9367257              0.43900870673E-01      
  8   1336.5743706              0.11028573632    
  9    582.87737501             0.22912630489    
 10    264.59511360             0.34779259246    
 11    123.77823320             0.29968722223    
S   4
  1   2311.1055804              0.75033084731E-02      
  2    716.27089868             0.74778386626E-01      
  3    275.45330910             0.35092882302    
  4    118.93292565             0.72055989686    
S   1
  1     58.435699085            1.0000000        
S   1
  1     26.261575973            1.0000000        
S   1
  1     12.664880671            1.0000000        
S   1
  1      5.7269548505           1.0000000        
S   1
  1      2.7555023203           1.0000000        
S   1
  1      1.2432886754           1.0000000        
S   1
  1      0.33107183846          1.0000000        
S   1
  1      0.15964081368          1.0000000        
S   1
  1      0.68463178923E-01            1.0000000        
P   9
  1  16555.7110740              0.10199370391E-03      
  2   3914.9903745              0.90504190546E-03      
  3   1269.4766518              0.51558490762E-02      
  4    484.35437789             0.22010335708E-01      
  5    204.64985822             0.73434798827E-01      
  6     92.791032094            0.18608955294    
  7     44.055060255            0.33330981945    
  8     21.601319931            0.36229776246    
  9     10.732169233            0.17765186263    
P   2
  1    100.88933962            -0.11146182144    
  2     36.640254741           -0.52324324314    
P   4
  1      8.0343224115           0.31484763263    
  2      4.5613438333           0.38737744790    
  3      3.1794882223           0.50034353638    
  4      0.92612041457          0.22656707948    
P   1
  1      1.7977040907           1.0000000        
P   1
  1      0.41386865432          1.0000000        
P   1
  1      0.15830798709          1.0000000        
P   1
  1      0.57877035911E-01            1.0000000        
D   7
  1    420.99565921             0.78212192196E-03      
  2    126.36209818             0.69560123831E-02      
  3     48.661473548            0.33712188323E-01      
  4     20.880325527            0.10717291194    
  5      9.5418229355           0.23161030141    
  6      4.4353653868           0.33390954301    
  7      2.0285421942           0.33720676378    
D   1
  1      0.89484935267          1.0000000        
D   1
  1      0.35786074334          1.0000000        
D   1
  1      0.1400000              1.0000000        
F   1
  1      8.9425329000           1.0000000        
F   1
  1      2.6920312990           1.0000000        
F   1
  1      0.54920000000          1.0000000        
F   1
  1      0.21900000000          1.0000000        
G   1
  1      0.46810000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: As
data:
ARSENIC
S   11
  1 8217482.6198000             0.70590618422E-05      
  2 1230500.3720000             0.54880889611E-04      
  3 280225.8664800              0.28809164698E-03      
  4  79482.5094150              0.12129779464E-02      
  5  25963.7833510              0.43914559880E-02      
  6   9381.4010193              0.14125362961E-01      
  7   3660.4911972              0.40657915618E-01      
  8   1518.2356024              0.10300382633    
  9    661.80098920             0.21730077101    
 10    300.58642127             0.33995751412    
 11    141.11137296             0.31088634077    
S   4
  1   2577.0870580              0.70752991980E-02      
  2    798.07872277             0.71383615256E-01      
  3    306.57574948             0.34287024634    
  4    132.27558802             0.74361403413    
S   1
  1     67.448702235            1.0000000        
S   1
  1     29.209180441            1.0000000        
S   1
  1     14.156509326            1.0000000        
S   1
  1      6.5561506682           1.0000000        
S   1
  1      3.1392847238           1.0000000        
S   1
  1      1.4294631050           1.0000000        
S   1
  1      0.41103390885          1.0000000        
S   1
  1      0.20032453310          1.0000000        
S   1
  1      0.85669928850E-01            1.0000000        
P   10
  1  25198.5042780              0.54758168372E-04      
  2   5972.5601381              0.48572462452E-03      
  3   1941.9123183              0.27908085625E-02      
  4    743.59381104             0.12201505962E-01      
  5    315.63828052             0.42666285138E-01      
  6    143.96878925             0.11870919141    
  7     69.068683164            0.24909407023    
  8     34.254305629            0.36061356903    
  9     17.371746759            0.29392241832    
 10      8.7634555628           0.97829057366E-01      
P   5
  1    228.49024582            -0.24900140765E-02      
  2     86.313555488           -0.19482515843E-01      
  3     36.751366267           -0.61495071038E-01      
  4      8.5365149464           0.47258065062    
  5      4.1935128599           1.0236065079     
P   1
  1      2.0464980417           1.0000000        
P   1
  1      0.98000000000          1.0000000        
P   1
  1      0.40534340618          1.0000000        
P   1
  1      0.16655070471          1.0000000        
P   1
  1      0.65981706123E-01            1.0000000        
D   7
  1    479.32599612             0.71722800196E-03      
  2    143.96064855             0.64419223046E-02      
  3     55.548909224            0.31776498964E-01      
  4     23.927581006            0.10276249168    
  5     10.988194172            0.22710952843    
  6      5.1489356262           0.33477474118    
  7      2.3836810892           0.34175986071    
D   1
  1      1.0688204667           1.0000000        
D   1
  1      0.43305693742          1.0000000        
D   1
  1      0.1700000              1.0000000        
F   1
  1     10.181096831            1.0000000        
F   1
  1      3.1280704550           1.0000000        
F   1
  1      0.26400000000          1.0000000        
F   1
  1      0.64400000000          1.0000000        
G   1
  1      0.54650000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: Se
data:
SELENIUM
S   11
  1 9520446.7743000             0.63309690150E-05      
  2 1424984.0802000             0.49267697990E-04      
  3 324127.5768200              0.25920249744E-03      
  4  91774.8769500              0.10943145743E-02      
  5  29932.7257250              0.39706139067E-02      
  6  10804.6179050              0.12801187916E-01      
  7   4214.0134779              0.36980379417E-01      
  8   1747.8116633              0.94461349896E-01      
  9    762.12160878             0.20274705434    
 10    346.45604141             0.32878956424    
 11    163.11569304             0.32300252609    
S   4
  1   2614.5153067              0.79113928518E-02      
  2    818.68552756             0.77187739408E-01      
  3    318.63398991             0.35672061949    
  4    139.04844125             0.75846750004    
S   1
  1     78.348734788            1.0000000        
S   1
  1     31.704290663            1.0000000        
S   1
  1     15.505859269            1.0000000        
S   1
  1      7.3227423625           1.0000000        
S   1
  1      3.4969483549           1.0000000        
S   1
  1      1.6121546085           1.0000000        
S   1
  1      0.49587158541          1.0000000        
S   1
  1      0.24092138175          1.0000000        
S   1
  1      0.10231739397          1.0000000        
P   10
  1  25360.2156150              0.60531790911E-04      
  2   5993.7896610              0.53987774437E-03      
  3   1943.0741755              0.31130456170E-02      
  4    742.35316156             0.13599674694E-01      
  5    314.62114597             0.47298958377E-01      
  6    143.34748044             0.12981487726    
  7     68.673617552            0.26569982215    
  8     34.013554117            0.36723195311    
  9     17.198099621            0.27478356345    
 10      8.5830329629           0.79256169683E-01      
P   5
  1    236.58209146            -0.12271649354E-02      
  2     90.576183214           -0.92584627774E-02      
  3     39.086689301           -0.28428728384E-01      
  4      9.3084344018           0.21201102192    
  5      4.6169923084           0.47117589805    
P   1
  1      2.2653477506           1.0000000        
P   1
  1      1.0800000000           1.0000000        
P   1
  1      0.47939328581          1.0000000        
P   1
  1      0.19619983845          1.0000000        
P   1
  1      0.76256339275E-01            1.0000000        
D   7
  1    539.48700124             0.66722955533E-03      
  2    162.13394435             0.60399330928E-02      
  3     62.661795641            0.30238666507E-01      
  4     27.077272889            0.99267892065E-01      
  5     12.483003929            0.22358036310    
  6      5.8864623136           0.33574682762    
  7      2.7519131105           0.34554856483    
D   1
  1      1.2500769617           1.0000000        
D   1
  1      0.51172841843          1.0000000        
D   1
  1      0.2000000              1.0000000        
F   1
  1     11.333391939            1.0000000        
F   1
  1      3.5185505690           1.0000000        
F   1
  1      0.28400000000          1.0000000        
F   1
  1      0.70970000000          1.0000000        
G   1
  1      0.57300000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: Br
data:
BROMINE
S   11
  1 10629044.2640000            0.59322104325E-05      
  2 1591918.2739000             0.46118980689E-04      
  3 362333.9843700              0.24244612378E-03      
  4 102643.1114100              0.10231422748E-02      
  5  33489.8466680              0.37121984175E-02      
  6  12091.2471900              0.11978107933E-01      
  7   4716.1908789              0.34682692842E-01      
  8   1956.1598080              0.89068331264E-01      
  9    853.08595848             0.19330124567    
 10    387.96633666             0.32071144956    
 11    182.85156613             0.32996797574    
S   4
  1   3240.4086421              0.65905194070E-02      
  2   1000.4631935              0.68439609656E-01      
  3    383.37301682             0.34495478668    
  4    166.03929698             0.82315542085    
S   1
  1     87.919906994            1.0000000        
S   1
  1     35.675840068            1.0000000        
S   1
  1     17.543657842            1.0000000        
S   1
  1      8.4473660433           1.0000000        
S   1
  1      3.9666180616           1.0000000        
S   1
  1      1.8356815987           1.0000000        
S   1
  1      0.59084778776          1.0000000        
S   1
  1      0.28863218421          1.0000000        
S   1
  1      0.12153380537          1.0000000        
P   10
  1  26566.4765790              0.62073657410E-04      
  2   6290.5088566              0.55131636217E-03      
  3   2043.3178410              0.31680110980E-02      
  4    781.67221007             0.13816597290E-01      
  5    331.51078945             0.48018539681E-01      
  6    151.09198667             0.13162015183    
  7     72.395278166            0.26860052203    
  8     35.869510844            0.36827391093    
  9     18.139906191            0.27108612944    
 10      9.0466688944           0.76215338633E-01      
P   5
  1    253.71822146            -0.13729169381E-02      
  2     97.250818058           -0.10393811185E-01      
  3     42.034897960           -0.32204214612E-01      
  4      9.9685673555           0.24224770086    
  5      4.9395854745           0.53557868398    
P   1
  1      2.4382845475           1.0000000        
P   1
  1      1.1800000000           1.0000000        
P   1
  1      0.51047564965          1.0000000        
P   1
  1      0.21215851928          1.0000000        
P   1
  1      0.83943604990E-01            1.0000000        
D   7
  1    601.44434484             0.62783723765E-03      
  2    180.85718640             0.57205157153E-02      
  3     69.986806340            0.29002521527E-01      
  4     30.324710300            0.96446989766E-01      
  5     14.027909238            0.22065825870    
  6      6.6511702082           0.33657642375    
  7      3.1354168338           0.34872040582    
D   1
  1      1.4393591843           1.0000000        
D   1
  1      0.59350441438          1.0000000        
D   1
  1      0.2300000              1.0000000        
F   1
  1     12.703062423            1.0000000        
F   1
  1      4.0083455670           1.0000000        
F   1
  1      0.34070000000          1.0000000        
F   1
  1      0.82570000000          1.0000000        
G   1
  1      0.64910000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: Kr
data:
KRYPTON
S   11
  1 11713823.0080000            0.56915790360E-05      
  2 1755253.3979000             0.44214471278E-04      
  3 399717.4192400              0.23227813842E-03      
  4 113285.7926000              0.97973661050E-03      
  5  36977.2052930              0.35537627541E-02      
  6  13355.0365800              0.11468673282E-01      
  7   5210.9012988              0.33241627469E-01      
  8   2162.1137020              0.85620725674E-01      
  9    943.29291023             0.18708766876    
 10    429.20724331             0.31497583326    
 11    202.40720840             0.33406191042    
S   4
  1   3260.4985521              0.73091509287E-02      
  2   1011.1069716              0.74040355445E-01      
  3    392.44359273             0.35414962222    
  4    173.21702132             0.80188286115    
S   1
  1     96.619988467            1.0000000        
S   1
  1     38.158284867            1.0000000        
S   1
  1     18.959517570            1.0000000        
S   1
  1      9.2505996199           1.0000000        
S   1
  1      4.3486517621           1.0000000        
S   1
  1      2.0380324209           1.0000000        
S   1
  1      0.69110152540          1.0000000        
S   1
  1      0.33506065143          1.0000000        
S   1
  1      0.14074441124          1.0000000        
P   10
  1  28609.3357670              0.60526369543E-04      
  2   6773.1236364              0.53786288403E-03      
  3   2199.8011079              0.30935356550E-02      
  4    841.50201590             0.13514318412E-01      
  5    356.92110288             0.47090086910E-01      
  6    162.71174351             0.12960370449    
  7     78.004264994            0.26607435646    
  8     38.682579997            0.36775851233    
  9     19.589158685            0.27406903542    
 10      9.7990863417           0.78773352304E-01      
P   5
  1    261.37786869            -0.16397212361E-02      
  2    100.09932146            -0.12034797573E-01      
  3     44.012139363           -0.34891485263E-01      
  4     10.854010739            0.25212650561    
  5      5.4351930182           0.57400781830    
P   1
  1      2.7062805542           1.0000000        
P   1
  1      1.3195633408           1.0000000        
P   1
  1      0.58004455967          1.0000000        
P   1
  1      0.24329976264          1.0000000        
P   1
  1      0.96823725087E-01            1.0000000        
D   7
  1    665.35057386             0.59588702935E-03      
  2    200.17995366             0.54594260457E-02      
  3     77.545085570            0.27980992479E-01      
  4     33.677854345            0.94119165910E-01      
  5     15.624928334            0.21825215619    
  6      7.4427867423           0.33739971242    
  7      3.5336073535           0.35141418853    
D   1
  1      1.6363725142           1.0000000        
D   1
  1      0.67845684728          1.0000000        
D   1
  1      0.2700000              1.0000000        
F   1
  1     14.180116992            1.0000000        
F   1
  1      4.5393183680           1.0000000        
F   1
  1      0.41300000000          1.0000000        
F   1
  1      0.95570000000          1.0000000        
G   1
  1      0.73950000000          1.0000000        


name: Def2-QZVPP
description: N/A
elt: Rb
data:
RUBIDIUM
S   2
  1      7.4744618040           0.26999390986    
  2      6.7296180594          -0.42624989529    
S   1
  1      2.7822883445           1.0000000        
S   1
  1      0.53494544647          1.0000000        
S   1
  1      0.22522959349          1.0000000        
S   1
  1      0.50765580412E-01            1.0000000        
S   1
  1      0.26940281781E-01            1.0000000        
S   1
  1      0.13051395489E-01            1.0000000        
P   4
  1      5.9998960731           0.54568549670E-01      
  2      3.2040784712          -0.26447792498    
  3      0.86991979950          0.50033505958    
  4      0.44104169728          0.75243449327    
P   1
  1      0.22139898232          1.0000000        
P   1
  1      0.10679039696          1.0000000        
P   1
  1      0.33292658822E-01            1.0000000        
P   1
  1      0.12847003750E-01            1.0000000        
D   2
  1      4.6530655240          -0.11653388661E-02      
  2      0.44914033653          0.15584297068    
D   1
  1      0.10089577190          1.0000000        
D   1
  1      0.27432280711E-01            1.0000000        
D   1
  1      0.95353625581E-02            1.0000000        
F   1
  1      0.0765800              1.0000000        
F   1
  1      0.4874400              1.0000000        
F   1
  1      1.1844800              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Sr
data:
STRONTIUM
S   2
  1     11.000000000           -0.26157031021    
  2      9.9000000000           0.36446668395    
S   1
  1      2.8771178206           1.0000000        
S   1
  1      0.63364987829          1.0000000        
S   1
  1      0.28588739731          1.0000000        
S   1
  1      0.61938540840E-01            1.0000000        
S   1
  1      0.31237518881E-01            1.0000000        
S   1
  1      0.16266139051E-01            1.0000000        
P   4
  1      7.6233499793           0.71548409039E-01      
  2      3.6643075442          -0.44232262175    
  3      0.97809648234          0.55690782709    
  4      0.77815253363          0.63437348922    
P   1
  1      0.40666316828          1.0000000        
P   1
  1      0.18725455934          1.0000000        
P   1
  1      0.56304594427E-01            1.0000000        
P   1
  1      0.21826701680E-01            1.0000000        
D   2
  1      4.3003648126          -0.43567751655E-02      
  2      0.84876551534          0.13176477946    
D   1
  1      0.29200562252          1.0000000        
D   1
  1      0.94733990946E-01            1.0000000        
D   1
  1      0.30479894317E-01            1.0000000        
F   1
  1      0.1094000              1.0000000        
F   1
  1      0.5408000              1.0000000        
F   1
  1      1.3460000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Y
data:
YTTRIUM
S   2
  1     12.000000000           -0.27445870024    
  2     10.800000000            0.37995468727    
S   1
  1      3.1007372195           1.0000000        
S   1
  1      0.74155427570          1.0000000        
S   1
  1      0.34176775775          1.0000000        
S   1
  1      0.79428797018E-01            1.0000000        
S   1
  1      0.43308336524E-01            1.0000000        
S   1
  1      0.21593224872E-01            1.0000000        
P   4
  1      8.0336135138           0.73041700172E-01      
  2      4.0181723477          -0.41610436192    
  3      1.1052105890           0.55451897342    
  4      0.83219316692          0.62307196069    
P   1
  1      0.44762676666          1.0000000        
P   1
  1      0.20523347112          1.0000000        
P   1
  1      0.55045561759E-01            1.0000000        
P   1
  1      0.22603027453E-01            1.0000000        
D   4
  1     13.755105347            0.23830583863E-02      
  2      3.9629908552          -0.25068021047E-01      
  3      1.3427449755           0.22348991872    
  4      0.62579248108          0.55237929771    
D   1
  1      0.27632363958          1.0000000        
D   1
  1      0.11706987754          1.0000000        
D   1
  1      0.46601501035E-01            1.0000000        
F   1
  1      0.7629100              1.0000000        
F   1
  1      0.2651500              1.0000000        
F   1
  1      0.0921500              1.0000000        
G   1
  1      0.3025000              1.0000000        
G   1
  1      0.1147400              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Zr
data:
ZIRCONIUM
S   2
  1     13.000000000            0.30219052022    
  2     11.750000000           -0.41145056914    
S   1
  1      3.3679085035           1.0000000        
S   1
  1      0.83813257389          1.0000000        
S   1
  1      0.39094081796          1.0000000        
S   1
  1      0.12165103956          1.0000000        
S   1
  1      0.68995924030E-01            1.0000000        
S   1
  1      0.28131941438E-01            1.0000000        
P   4
  1      8.6639962104           0.73773984271E-01      
  2      4.4109566148          -0.40022747074    
  3      1.2360133871           0.54947233625    
  4      0.87445820593          0.61937721413    
P   1
  1      0.47713887642          1.0000000        
P   1
  1      0.21764845261          1.0000000        
P   1
  1      0.57837163627E-01            1.0000000        
P   1
  1      0.20242456645E-01            1.0000000        
D   4
  1     14.106535710            0.29285547494E-02      
  2      5.0597471810          -0.19680100129E-01      
  3      1.4340490314           0.24763912308    
  4      0.65933129072          0.53572735030    
D   1
  1      0.28894952351          1.0000000        
D   1
  1      0.12160731860          1.0000000        
D   1
  1      0.48470078407E-01            1.0000000        
F   1
  1      1.1417100              1.0000000        
F   1
  1      0.3926100              1.0000000        
F   1
  1      0.1350100              1.0000000        
G   1
  1      0.5307300              1.0000000        
G   1
  1      0.1896900              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Nb
data:
NIOBIUM
S   2
  1     13.500000000           -0.32410606901    
  2     12.200000000            0.44773333772    
S   1
  1      3.7169274051           1.0000000        
S   1
  1      0.90652488058          1.0000000        
S   1
  1      0.41577606051          1.0000000        
S   1
  1      0.11042511303          1.0000000        
S   1
  1      0.62821821279E-01            1.0000000        
S   1
  1      0.28016289999E-01            1.0000000        
P   4
  1      9.3098091725           0.73705483583E-01      
  2      4.8178682975          -0.38234456657    
  3      1.3632838380           0.54987821838    
  4      0.90647526151          0.61931035808    
P   1
  1      0.50089563075          1.0000000        
P   1
  1      0.22793279437          1.0000000        
P   1
  1      0.60000000000E-01            1.0000000        
P   1
  1      0.20600000000E-01            1.0000000        
D   4
  1     17.364404474            0.26413526976E-02      
  2      5.3680385855          -0.20806369564E-01      
  3      1.6586089067           0.24555637053    
  4      0.78121461396          0.53651499644    
D   1
  1      0.34874234803          1.0000000        
D   1
  1      0.14844540532          1.0000000        
D   1
  1      0.59334919015E-01            1.0000000        
F   1
  1      1.5360500              1.0000000        
F   1
  1      0.5227000              1.0000000        
F   1
  1      0.1778700              1.0000000        
G   1
  1      0.7831800              1.0000000        
G   1
  1      0.2646400              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Mo
data:
MOLYBDENUM
S   3
  1     15.000000000            0.57082903143E-01      
  2     13.500000000           -0.66824799324    
  3     12.571764111            0.75521146249    
S   1
  1      4.1304342348           1.0000000        
S   1
  1      0.96478113331          1.0000000        
S   1
  1      0.43736648981          1.0000000        
S   1
  1      0.11318605514          1.0000000        
S   1
  1      0.57579423658E-01            1.0000000        
S   1
  1      0.27018151462E-01            1.0000000        
P   4
  1      9.1087343439           0.10192125262    
  2      5.3495476626          -0.38460279534    
  3      1.4870196599           0.53457134734    
  4      0.90585473836          0.61724117143    
P   1
  1      0.50141240214          1.0000000        
P   1
  1      0.23286318145          1.0000000        
P   1
  1      0.62000000000E-01            1.0000000        
P   1
  1      0.21000000000E-01            1.0000000        
D   4
  1     17.215377137            0.30147475909E-02      
  2      5.8496916871          -0.28923836319E-01      
  3      1.8232967249           0.25398642015    
  4      0.86970233105          0.52725603860    
D   1
  1      0.39461697588          1.0000000        
D   1
  1      0.17084141240          1.0000000        
D   1
  1      0.69272819629E-01            1.0000000        
F   1
  1      1.9462500              1.0000000        
F   1
  1      0.6554500              1.0000000        
F   1
  1      0.2207400              1.0000000        
G   1
  1      1.0598000              1.0000000        
G   1
  1      0.3395800              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Tc
data:
TECHNETIUM
S   3
  1     15.000000000           -0.31349221639    
  2     13.500000000            0.44793618799    
  3      7.1022525122           0.20051786822E-01      
S   1
  1      4.4415995038           1.0000000        
S   1
  1      1.0660127848           1.0000000        
S   1
  1      0.48568559673          1.0000000        
S   1
  1      0.12654965451          1.0000000        
S   1
  1      0.66997954399E-01            1.0000000        
S   1
  1      0.29822104753E-01            1.0000000        
P   4
  1     10.298029968            0.83867175334E-01      
  2      5.7213792785          -0.36246957884    
  3      1.6296063991           0.53649463822    
  4      0.97528623230          0.61837212480    
P   1
  1      0.53997625690          1.0000000        
P   1
  1      0.25172025379          1.0000000        
P   1
  1      0.64000000000E-01            1.0000000        
P   1
  1      0.21500000000E-01            1.0000000        
D   4
  1     18.617708386            0.27056783609E-02      
  2      5.8369803972          -0.35968645824E-01      
  3      2.0921979438           0.21334851537    
  4      1.0148117201           0.45713971996    
D   1
  1      0.46154215497          1.0000000        
D   1
  1      0.19795071041          1.0000000        
D   1
  1      0.78619872304E-01            1.0000000        
F   1
  1      2.3724000              1.0000000        
F   1
  1      0.7908000              1.0000000        
F   1
  1      0.2636000              1.0000000        
F   1
  1      0.0878700              1.0000000        
G   1
  1      1.3606500              1.0000000        
G   1
  1      0.4145300              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ru
data:
RUTHENIUM
S   3
  1     15.000000000            0.40205707045    
  2     13.500000000           -0.59417167365    
  3      7.2130868530           0.12541032854    
S   1
  1      4.5405901225           1.0000000        
S   1
  1      1.1904973723           1.0000000        
S   1
  1      0.54307531590          1.0000000        
S   1
  1      0.13700563039          1.0000000        
S   1
  1      0.73396375028E-01            1.0000000        
S   1
  1      0.31250715458E-01            1.0000000        
P   4
  1     11.388100061            0.55871461629E-01      
  2      6.1591005666          -0.25808446847    
  3      1.7320431063           0.42924265341    
  4      1.0194857402           0.43313353048    
P   1
  1      0.58131419111          1.0000000        
P   1
  1      0.27290530268          1.0000000        
P   1
  1      0.66000000000E-01            1.0000000        
P   1
  1      0.22000000000E-01            1.0000000        
D   4
  1     18.598247778            0.31556859652E-02      
  2      6.7883773752          -0.34551060293E-01      
  3      2.2470797667           0.21708566158    
  4      1.0884195428           0.42834135307    
D   1
  1      0.49787892886          1.0000000        
D   1
  1      0.21481968266          1.0000000        
D   1
  1      0.85666751170E-01            1.0000000        
F   1
  1      2.8246600              1.0000000        
F   1
  1      0.9431400              1.0000000        
F   1
  1      0.3149100              1.0000000        
F   1
  1      0.1051500              1.0000000        
G   1
  1      1.7089400              1.0000000        
G   1
  1      0.5387300              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Rh
data:
RHODIUM
S   3
  1     15.000000000            0.50258059140    
  2     13.500000000           -0.76433277918    
  3      7.4051116103           0.31145290674    
S   1
  1      4.5131696431           1.0000000        
S   1
  1      1.3235977422           1.0000000        
S   1
  1      0.60954144541          1.0000000        
S   1
  1      0.18907192773          1.0000000        
S   1
  1      0.89080450794E-01            1.0000000        
S   1
  1      0.34131567514E-01            1.0000000        
P   4
  1     11.839425278            0.59787418531E-01      
  2      6.6953652636          -0.24743454054    
  3      1.8333616287           0.42987003231    
  4      1.0267931770           0.42547313311    
P   1
  1      0.58071767020          1.0000000        
P   1
  1      0.27907753269          1.0000000        
P   1
  1      0.67108954625E-01            1.0000000        
P   1
  1      0.22101542156E-01            1.0000000        
D   4
  1     26.341167176            0.20623159685E-02      
  2      7.8709462705          -0.17239329053E-01      
  3      2.5989970939           0.17284839402    
  4      1.2613435752           0.36282102279    
D   1
  1      0.57578407979          1.0000000        
D   1
  1      0.24725174897          1.0000000        
D   1
  1      0.97531210324E-01            1.0000000        
F   1
  1      3.2739100              1.0000000        
F   1
  1      1.0949900              1.0000000        
F   1
  1      0.3662300              1.0000000        
F   1
  1      0.1224900              1.0000000        
G   1
  1      2.0298900              1.0000000        
G   1
  1      0.6629400              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Pd
data:
PALLADIUM
S   3
  1     15.262399331            0.44145727454    
  2     13.721983176           -0.70293005979    
  3      4.8448286268           0.36095390108    
S   1
  1      8.7309326588           1.0000000        
S   1
  1      1.4357564094           1.0000000        
S   1
  1      0.66088433720          1.0000000        
S   1
  1      0.20897212790          1.0000000        
S   1
  1      0.91936735872E-01            1.0000000        
S   1
  1      0.34733479706E-01            1.0000000        
P   4
  1     12.585237008            0.60002003747E-01      
  2      7.2058104839          -0.24022183118    
  3      1.9558705640           0.43424940067    
  4      1.0534418618           0.42084436088    
P   1
  1      0.59809389552          1.0000000        
P   1
  1      0.30362411297          1.0000000        
P   1
  1      0.88000000000E-01            1.0000000        
P   1
  1      0.30000000000E-01            1.0000000        
D   4
  1     28.840985892            0.21131470308E-02      
  2      8.4584163440          -0.17913194955E-01      
  3      2.8648941754           0.17165507663    
  4      1.3966488847           0.36149251150    
D   1
  1      0.63921677230          1.0000000        
D   1
  1      0.27502319836          1.0000000        
D   1
  1      0.10829940074          1.0000000        
F   1
  1      3.7200000              1.0000000        
F   1
  1      1.2462900              1.0000000        
F   1
  1      0.4175400              1.0000000        
F   1
  1      0.1398900              1.0000000        
G   1
  1      2.3234500              1.0000000        
G   1
  1      0.7871500              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ag
data:
SILVER
S   4
  1    256.50898381             0.73215128094E-03      
  2     19.000000000           -0.14706983774    
  3     14.129749737            0.47914881797    
  4      9.4840599768          -0.26930801705    
S   1
  1      5.5812682897           1.0000000        
S   1
  1      1.4763753299           1.0000000        
S   1
  1      0.66184584335          1.0000000        
S   1
  1      0.15382171742          1.0000000        
S   1
  1      0.79534248689E-01            1.0000000        
S   1
  1      0.32408624506E-01            1.0000000        
P   4
  1     13.350389537            0.62479151672E-01      
  2      7.7163302467          -0.24398688175    
  3      2.0864535219           0.45439758415    
  4      1.0577805733           0.47607485340    
P   1
  1      0.52564427657          1.0000000        
P   1
  1      0.23694908895          1.0000000        
P   1
  1      0.66457980332E-01            1.0000000        
P   1
  1      0.21864839286E-01            1.0000000        
D   4
  1     32.147961274            0.34564677092E-02      
  2      9.0323725307          -0.28135297216E-01      
  3      3.1673540854           0.26999486025    
  4      1.5519381135           0.57666767772    
D   1
  1      0.71310284000          1.0000000        
D   1
  1      0.30749741551          1.0000000        
D   1
  1      0.12094304210          1.0000000        
F   1
  1      4.1631100              1.0000000        
F   1
  1      1.3971100              1.0000000        
F   1
  1      0.4688600              1.0000000        
F   1
  1      0.1573500              1.0000000        
G   1
  1      2.5896000              1.0000000        
G   1
  1      0.9113500              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Cd
data:
CADMIUM
S   4
  1    269.30016289             0.62688949336E-03      
  2     18.554269093           -0.43456616075    
  3     16.729943183            0.66043072415    
  4     11.768546646           -0.11793513277    
S   1
  1      6.1816604427           1.0000000        
S   1
  1      1.5775743989           1.0000000        
S   1
  1      0.71857981187          1.0000000        
S   1
  1      0.16433138409          1.0000000        
S   1
  1      0.76794158768E-01            1.0000000        
S   1
  1      0.34377199848E-01            1.0000000        
P   4
  1     14.107678180            0.70307291426E-01      
  2      8.2750040714          -0.26474818030    
  3      2.2507338323           0.47494851120    
  4      1.1914970238           0.46327020832    
P   1
  1      0.66041257699          1.0000000        
P   1
  1      0.33804403770          1.0000000        
P   1
  1      0.96004037879E-01            1.0000000        
P   1
  1      0.33681030012E-01            1.0000000        
D   4
  1     35.689192548            0.44455913982E-02      
  2      9.3407971610          -0.39185351747E-01      
  3      3.5922659140           0.31235972097    
  4      1.7980676976           0.71163739606    
D   1
  1      0.84830057791          1.0000000        
D   1
  1      0.37846492753          1.0000000        
D   1
  1      0.15420101631          1.0000000        
F   1
  1      4.7689900              1.0000000        
F   1
  1      1.5981300              1.0000000        
F   1
  1      0.5355500              1.0000000        
F   1
  1      0.1794700              1.0000000        
G   1
  1      2.9414200              1.0000000        
G   1
  1      1.0371000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Cs
data:
CESIUM
S   3
  1      5.8684829520           0.12906631816    
  2      4.3741038860          -0.34380446158    
  3      1.7951201473           0.69937346606    
S   1
  1      0.37816941125          1.0000000        
S   1
  1      0.16624693130          1.0000000        
S   1
  1      0.27763176052E-01            1.0000000        
S   1
  1      0.16113005842E-01            1.0000000        
S   1
  1      0.10996108743E-01            1.0000000        
P   3
  1      4.2749775718           0.45595316685E-01      
  2      1.9639316240          -0.25031125651    
  3      0.47666322385          0.55660114378    
P   1
  1      0.21736718772          1.0000000        
P   1
  1      0.97276293828E-01            1.0000000        
P   1
  1      0.26770518041E-01            1.0000000        
P   1
  1      0.10845412222E-01            1.0000000        
D   2
  1      2.0091044335          -0.34453182058E-02      
  2      0.35778351451          0.22686596025    
D   1
  1      0.11070568254          1.0000000        
D   1
  1      0.33216214821E-01            1.0000000        
D   1
  1      0.11409380652E-01            1.0000000        
F   1
  1      0.0700000              1.0000000        
F   1
  1      0.3493300              1.0000000        
F   1
  1      0.8469300              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ba
data:
BARIUM
S   2
  1      5.7000000000           1.3292982002     
  2      5.2043612469          -1.7367497134     
S   1
  1      2.1475437282           1.0000000        
S   1
  1      0.41033660537          1.0000000        
S   1
  1      0.18393532770          1.0000000        
S   1
  1      0.72521216545E-01            1.0000000        
S   1
  1      0.34526334903E-01            1.0000000        
S   1
  1      0.16157891872E-01            1.0000000        
P   4
  1      5.6000000000           0.51385026013    
  2      5.1104879274          -0.70529238864    
  3      2.5006544803           0.42822329830    
  4      0.51947995345         -0.57125984472    
P   1
  1      0.24536994841          1.0000000        
P   1
  1      0.11256056700          1.0000000        
P   1
  1      0.34917622027E-01            1.0000000        
P   1
  1      0.16320065666E-01            1.0000000        
D   3
  1      2.7000000000           0.14372069823827 
  2      2.3460740881          -0.19565347309413 
  3      0.39553542609          0.29963058551591 
D   1
  1      0.12967935859          1.0000000        
D   1
  1      0.40463066544E-01            1.0000000        
F   1
  1      0.0878800              1.0000000        
F   1
  1      0.3659000              1.0000000        
F   1
  1      0.8731000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: La
data:
LANTHANUM
S   3
  1     26.077272000            0.23198684846E-02      
  2      5.7127838000          -0.29787719611    
  3      4.4057848000           0.70022722515    
S   1
  1      2.1315325829           1.0000000        
S   1
  1      0.49385808956          1.0000000        
S   1
  1      0.23595687888          1.0000000        
S   1
  1      0.63593489661E-01            1.0000000        
S   1
  1      0.31545394754E-01            1.0000000        
S   1
  1      0.15777655296E-01            1.0000000        
P   4
  1      6.0000000000          -0.11397960924E-01      
  2      3.6808191615           0.14675038550    
  3      2.3265462081          -0.35581819167    
  4      0.64342629633          0.45834955229    
P   1
  1      0.33584281962          1.0000000        
P   1
  1      0.16519051916          1.0000000        
P   1
  1      0.56715971797E-01            1.0000000        
P   1
  1      0.22100824776E-01            1.0000000        
D   3
  1      1.2000000000          -0.35803482414    
  2      1.0239524401           0.40483734122    
  3      0.37508490282          0.37649639849    
D   1
  1      0.17161940245          1.0000000        
D   1
  1      0.78780423402E-01            1.0000000        
D   1
  1      0.35000047794E-01            1.0000000        
F   1
  1      0.6558000              1.0000000        
F   1
  1      0.2568300              1.0000000        
F   1
  1      0.1005800              1.0000000        
G   1
  1      0.3321800              1.0000000        
G   1
  1      0.1353800              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Hf
data:
HAFNIUM
S   4
  1     24.000000000            0.19369448644    
  2     16.000000000           -3.5064630782     
  3     14.400000000            4.3082581000     
  4     10.304504667           -0.91045809742    
S   1
  1      3.8372797792           1.0000000        
S   1
  1      0.94649028050          1.0000000        
S   1
  1      0.44397931299          1.0000000        
S   1
  1      0.13656009445          1.0000000        
S   1
  1      0.66549732509E-01            1.0000000        
S   1
  1      0.28719110054E-01            1.0000000        
P   4
  1     17.000000000           -0.30316491880E-01      
  2     11.738072097            0.10139279686    
  3      4.9203967161          -0.28227924657    
  4      1.1251726138           0.52032008501    
P   1
  1      0.54220114055          1.0000000        
P   1
  1      0.25659447877          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
D   3
  1      6.9644775309           0.90606952386E-01      
  2      5.7275227587          -0.16459899714    
  3      1.1503305416           0.51375718250    
D   1
  1      0.47559482991          1.0000000        
D   1
  1      0.18774414759          1.0000000        
D   1
  1      0.68439488104E-01            1.0000000        
F   1
  1      0.8038700              1.0000000        
F   1
  1      0.3154700              1.0000000        
F   1
  1      0.1238000              1.0000000        
G   1
  1      0.4882000              1.0000000        
G   1
  1      0.1892600              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ta
data:
TANTALUM
S   4
  1     24.473650944            0.20537515818    
  2     18.721372549           -0.74477445680    
  3     11.500000000            3.4067771001     
  4     10.350000000           -2.8222400335     
S   1
  1      3.8125414615           1.0000000        
S   1
  1      1.0507430630           1.0000000        
S   1
  1      0.49732275755          1.0000000        
S   1
  1      0.15602650970          1.0000000        
S   1
  1      0.75056442354E-01            1.0000000        
S   1
  1      0.31632668803E-01            1.0000000        
P   4
  1     17.000000000           -0.32577305616E-01      
  2     12.008186536            0.10336287365    
  3      5.0278760583          -0.28526521696    
  4      1.1937124184           0.51790141155    
P   1
  1      0.57889707053          1.0000000        
P   1
  1      0.27225198801          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
D   3
  1      7.1419762952           0.88606814221E-01      
  2      5.7696869171          -0.17156962221    
  3      1.2199483941           0.53547693505    
D   1
  1      0.52366034246          1.0000000        
D   1
  1      0.21384808767          1.0000000        
D   1
  1      0.80254256735E-01            1.0000000        
F   1
  1      0.9507000              1.0000000        
F   1
  1      0.3738600              1.0000000        
F   1
  1      0.1470200              1.0000000        
G   1
  1      0.6577700              1.0000000        
G   1
  1      0.2431400              1.0000000        


name: Def2-QZVPP
description: N/A
elt: W
data:
TUNGSTEN
S   4
  1     22.106487883            0.66320504570    
  2     18.958062620           -1.5576189160     
  3     13.128699049            2.1416485467     
  4     10.149417378           -1.1823364947     
S   1
  1      4.0160322414           1.0000000        
S   1
  1      1.1234496158           1.0000000        
S   1
  1      0.53500662821          1.0000000        
S   1
  1      0.17127449658          1.0000000        
S   1
  1      0.80452897876E-01            1.0000000        
S   1
  1      0.33669872229E-01            1.0000000        
P   4
  1     17.000000000           -0.37817768433E-01      
  2     12.431973432            0.10905673845    
  3      5.1586217658          -0.29399955020    
  4      1.2801454812           0.51560726697    
P   1
  1      0.62856790898          1.0000000        
P   1
  1      0.29380423553          1.0000000        
P   1
  1      0.10000000000          1.0000000        
P   1
  1      0.41700000000E-01            1.0000000        
D   3
  1      7.4064737315           0.86993963018E-01      
  2      5.9026268603          -0.17667540011    
  3      1.2984756750           0.55145697030    
D   1
  1      0.57153508541          1.0000000        
D   1
  1      0.23845526606          1.0000000        
D   1
  1      0.91144267331E-01            1.0000000        
F   1
  1      1.0962400              1.0000000        
F   1
  1      0.4319900              1.0000000        
F   1
  1      0.1702300              1.0000000        
G   1
  1      0.8408900              1.0000000        
G   1
  1      0.2970200              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Re
data:
RHENIUM
S   4
  1     24.000000000            0.26968047163    
  2     18.204262749           -1.3559378623     
  3     14.048192487            1.9003709759     
  4      9.5166786954          -0.75626964015    
S   1
  1      4.1714667981           1.0000000        
S   1
  1      1.1944213976           1.0000000        
S   1
  1      0.56755447797          1.0000000        
S   1
  1      0.17533854868          1.0000000        
S   1
  1      0.82014250464E-01            1.0000000        
S   1
  1      0.34607892740E-01            1.0000000        
P   4
  1     18.000000000           -0.26890962397E-01      
  2     12.318606250            0.99711498502E-01      
  3      5.3719234505          -0.29289398145    
  4      1.3506646748           0.51466301434    
P   1
  1      0.66212816808          1.0000000        
P   1
  1      0.31071385193          1.0000000        
P   1
  1      0.10800000000          1.0000000        
P   1
  1      0.45000000000E-01            1.0000000        
D   3
  1      7.7352877672           0.83901798556E-01      
  2      6.0949443610          -0.17722258734    
  3      1.3871105497           0.55238259692    
D   1
  1      0.62324027854          1.0000000        
D   1
  1      0.26517328547          1.0000000        
D   1
  1      0.10321096849          1.0000000        
F   1
  1      1.2406000              1.0000000        
F   1
  1      0.4898900              1.0000000        
F   1
  1      0.1934500              1.0000000        
F   1
  1      0.0763900              1.0000000        
G   1
  1      1.0375800              1.0000000        
G   1
  1      0.3509000              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Os
data:
OSMIUM
S   4
  1     24.000000000            0.24559132972    
  2     18.204262749           -1.3020204925     
  3     14.048192487            1.9114896000     
  4      9.5166786954          -0.83098846799    
S   1
  1      4.2529406042           1.0000000        
S   1
  1      1.2999583502           1.0000000        
S   1
  1      0.61756850127          1.0000000        
S   1
  1      0.18785305474          1.0000000        
S   1
  1      0.87865523960E-01            1.0000000        
S   1
  1      0.37004242944E-01            1.0000000        
P   4
  1     15.500000000            0.16016463376    
  2     14.000000000           -0.23201520402    
  3      5.5458290420           0.29772587274    
  4      1.4139502215          -0.54253238176    
P   1
  1      0.68136686765          1.0000000        
P   1
  1      0.30911452647          1.0000000        
P   1
  1      0.90000000000E-01            1.0000000        
P   1
  1      0.33000000000E-01            1.0000000        
D   3
  1      8.5557226523           0.55081304746E-01      
  2      6.1927250845          -0.15041777374    
  3      1.4916733698           0.55087247584    
D   1
  1      0.67423241512          1.0000000        
D   1
  1      0.28635737076          1.0000000        
D   1
  1      0.11074292707          1.0000000        
F   1
  1      1.3802600              1.0000000        
F   1
  1      0.5506500              1.0000000        
F   1
  1      0.2196800              1.0000000        
F   1
  1      0.0876400              1.0000000        
G   1
  1      1.2249700              1.0000000        
G   1
  1      0.4280300              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Ir
data:
IRIDIUM
S   4
  1     23.465507222            0.71085679679    
  2     20.657091116           -1.5723547785     
  3     15.725107858            1.2938086001     
  4      7.9297463605          -0.42980466966    
S   1
  1      4.5196120103           1.0000000        
S   1
  1      1.3392891402           1.0000000        
S   1
  1      0.63692276928          1.0000000        
S   1
  1      0.19126770642          1.0000000        
S   1
  1      0.87881999015E-01            1.0000000        
S   1
  1      0.37643105533E-01            1.0000000        
P   4
  1     15.902664143           -0.16290720099    
  2     14.415830698            0.23483212987    
  3      5.7597608991          -0.30305337176    
  4      1.5008913108           0.55512982069    
P   1
  1      0.72348035957          1.0000000        
P   1
  1      0.32785980328          1.0000000        
P   1
  1      0.91000000000E-01            1.0000000        
P   1
  1      0.35000000000E-01            1.0000000        
D   3
  1      8.9686781612           0.29754685954E-01      
  2      6.4456319498          -0.82246052942E-01      
  3      1.5835819740           0.29212392062    
D   1
  1      0.71871917882          1.0000000        
D   1
  1      0.30539233284          1.0000000        
D   1
  1      0.11791405498          1.0000000        
F   1
  1      1.5134800              1.0000000        
F   1
  1      0.6100800              1.0000000        
F   1
  1      0.2459200              1.0000000        
F   1
  1      0.0991300              1.0000000        
G   1
  1      1.3977000              1.0000000        
G   1
  1      0.5051600              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Pt
data:
PLATINUM
S   4
  1     23.465507222            0.55150926143    
  2     20.657091116           -1.2690274107     
  3     15.725107858            1.1215145470     
  4      7.9297463605          -0.42250178029    
S   1
  1      4.6667116243           1.0000000        
S   1
  1      1.4202522633           1.0000000        
S   1
  1      0.66786671541          1.0000000        
S   1
  1      0.19745059689          1.0000000        
S   1
  1      0.92573920368E-01            1.0000000        
S   1
  1      0.38895936899E-01            1.0000000        
P   4
  1     15.500000000           -0.15672718629    
  2     14.000000000            0.23853412989    
  3      6.1161212339          -0.31041379733    
  4      1.5715586385           0.56473525089    
P   1
  1      0.75132510781          1.0000000        
P   1
  1      0.33306466812          1.0000000        
P   1
  1      0.91000000000E-01            1.0000000        
P   1
  1      0.35000000000E-01            1.0000000        
D   3
  1      8.3207937611           0.62945508668E-01      
  2      7.4207226520          -0.90271154330E-01      
  3      1.6570410639           0.16812340903    
D   1
  1      0.73943569960          1.0000000        
D   1
  1      0.30508290090          1.0000000        
D   1
  1      0.11350435924          1.0000000        
F   1
  1      1.6402500              1.0000000        
F   1
  1      0.6681300              1.0000000        
F   1
  1      0.2721500              1.0000000        
F   1
  1      0.1108600              1.0000000        
G   1
  1      1.5557500              1.0000000        
G   1
  1      0.5822800              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Au
data:
GOLD
S   3
  1     24.200000000            1.4645004443     
  2     22.000000000           -3.9770190496     
  3     20.000000000            2.7298033533     
S   1
  1      5.4043553001           1.0000000        
S   1
  1      1.4532546773           1.0000000        
S   1
  1      0.68294298420          1.0000000        
S   1
  1      0.19002755303          1.0000000        
S   1
  1      0.88155981740E-01            1.0000000        
S   1
  1      0.37739555187E-01            1.0000000        
P   4
  1     15.500000000            0.15001711880    
  2     14.000000000           -0.23609813183    
  3      6.4227368205           0.31458896948    
  4      1.6595601681          -0.57279670446    
P   1
  1      0.79402913993          1.0000000        
P   1
  1      0.35125155397          1.0000000        
P   1
  1      0.81000000000E-01            1.0000000        
P   1
  1      0.25000000000E-01            1.0000000        
D   3
  1      8.6000000000           0.15361654684    
  2      7.8531899379          -0.20443530663    
  3      1.7650856798           0.30781811607    
D   1
  1      0.79482263260          1.0000000        
D   1
  1      0.33085396360          1.0000000        
D   1
  1      0.12398535801          1.0000000        
F   1
  1      1.7607400              1.0000000        
F   1
  1      0.7248200              1.0000000        
F   1
  1      0.2983800              1.0000000        
F   1
  1      0.1228300              1.0000000        
G   1
  1      1.6991700              1.0000000        
G   1
  1      0.6594100              1.0000000        


name: Def2-QZVPP
description: N/A
elt: Hg
data:
MERCURY
S   3
  1     48.013786990            0.56241403333E-02      
  2     21.239875095           -0.17054083503    
  3     15.876100879            0.35940389661    
S   1
  1      5.4865939429           1.0000000        
S   1
  1      1.5521766895           1.0000000        
S   1
  1      0.74742541187          1.0000000        
S   1
  1      0.20268838483          1.0000000        
S   1
  1      0.93376229211E-01            1.0000000        
S   1
  1      0.41248705609E-01            1.0000000        
P   4
  1     17.500000000           -0.86457187331E-01      
  2     15.252594855            0.15327318234    
  3      6.4404715169          -0.30274955249    
  4      1.8180159920           0.54361285026    
P   1
  1      0.90067981801          1.0000000        
P   1
  1      0.41304540122          1.0000000        
P   1
  1      0.11845702655          1.0000000        
P   1
  1      0.36087619349E-01            1.0000000        
D   4
  1     11.888648987            0.13311219898E-01      
  2      6.7773660954          -0.73346199848E-01      
  3      2.0934941340           0.24155986719    
  4      1.0817087176           0.38865972362    
D   1
  1      0.53329136060          1.0000000        
D   1
  1      0.24984101827          1.0000000        
D   1
  1      0.10879770063          1.0000000        
F   1
  1      1.8893800              1.0000000        
F   1
  1      0.7956900              1.0000000        
F   1
  1      0.3351000              1.0000000        
F   1
  1      0.1411200              1.0000000        
G   1
  1      1.8358500              1.0000000        
G   1
  1      0.7224900              1.0000000        


name: Def2-QZVPPD
description: def2-QZVPPD Quadruple-Zeta-Valence basis set + Two Sets of Polarization + Diffuse basis functions
elt: Na
data:
SODIUM
S   10
  1 379852.2008100              0.20671384468E-04      
  2  56886.0063780              0.16070466617E-03      
  3  12942.7018380              0.84462905848E-03      
  4   3664.3017904              0.35519026029E-02      
  5   1194.7417499              0.12754034468E-01      
  6    430.98192917             0.39895462742E-01      
  7    167.83169424             0.10720154498    
  8     69.306669040            0.23339516913    
  9     29.951170886            0.36333077287    
 10     13.380791097            0.30544770974    
S   3
  1    121.74011283             0.36142427284E-01      
  2     37.044143387            0.28820961687    
  3     13.995422624            0.79337384869    
S   1
  1      5.9827797428           1.0000000        
S   1
  1      2.4830455118           1.0000000        
S   1
  1      1.0452506187           1.0000000        
S   1
  1      0.43875640383          1.0000000        
S   1
  1      0.65595633185E-01            1.0000000        
S   1
  1      0.30561925072E-01            1.0000000        
S   1
  1      0.15509064018E-01            1.0000000        
P   8
  1    690.77627017             0.37478518415E-03      
  2    163.82806121             0.31775441030E-02      
  3     52.876460769            0.16333581338E-01      
  4     19.812270493            0.59754902585E-01      
  5      8.1320378784           0.15879328812    
  6      3.4969068377           0.29049363260    
  7      1.5117244146           0.36368131139    
  8      0.64479294912          0.28195867334    
P   1
  1      0.26145823312          1.0000000        
P   1
  1      0.11704726116          1.0000000        
P   1
  1      0.40494747666E-01            1.0000000        
P   1
  1      0.15666707355E-01            1.0000000        
D   1
  1      5.3000000000           1.0000000        
D   1
  1      1.5900000000           1.0000000        
D   1
  1      0.23000000000          1.0000000        
D   1
  1      0.75700000000E-01            1.0000000        
F   1
  1      4.2700000000           1.0000000        
F   1
  1      0.13500000000          1.0000000        


name: Def2-QZVPPD
description: def2-QZVPPD Quadruple-Zeta-Valence basis set + Two Sets of Polarization + Diffuse basis functions
elt: Mg
data:
MAGNESIUM
S   10
  1 605967.7875300              0.14430176617E-04      
  2  90569.0946920              0.11249871807E-03      
  3  20574.2528440              0.59264972450E-03      
  4   5818.6284865              0.24988770424E-02      
  5   1895.6296075              0.90230775141E-02      
  6    683.45941021             0.28579919806E-01      
  7    266.18219762             0.79064453923E-01      
  8    110.11220010             0.18269337814    
  9     47.777041234            0.32157193967    
 10     21.542166149            0.35028259389    
S   3
  1    174.12136378             0.22931111278E-01      
  2     53.484972498            0.19151777552    
  3     20.500213307            0.61155711055    
S   1
  1      9.8056826922           1.0000000        
S   1
  1      3.5402989348           1.0000000        
S   1
  1      1.5450850046           1.0000000        
S   1
  1      0.66540195432          1.0000000        
S   1
  1      0.14355439071          1.0000000        
S   1
  1      0.66624673468E-01            1.0000000        
S   1
  1      0.29772648266E-01            1.0000000        
P   8
  1    893.20460829             0.34958267428E-03      
  2    211.78258286             0.29811890111E-02      
  3     68.443200537            0.15517845758E-01      
  4     25.727265349            0.57578659557E-01      
  5     10.606634281            0.15610307853    
  6      4.5934126484           0.29230912580    
  7      2.0100469807           0.37219024072    
  8      0.87384841536          0.27578088891    
P   1
  1      0.35615076666          1.0000000        
P   1
  1      0.18995954356          1.0000000        
P   1
  1      0.74580135669E-01            1.0000000        
P   1
  1      0.29221641309E-01            1.0000000        
D   1
  1      6.9300000000           1.0000000        
D   1
  1      2.1000000000           1.0000000        
D   1
  1      0.65000000000          1.0000000        
D   1
  1      0.20000000000          1.0000000        
D   1
  1      0.52000000000E-01            1.0000000        
F   1
  1      5.6000000000           1.0000000        
F   1
  1      0.16000000000          1.0000000        


name: Def2-QZVPPD
description: def2-QZVPPD Quadruple-Zeta-Valence basis set + Two Sets of Polarization + Diffuse basis functions
elt: K
data:
POTASSIUM
S   11
  1 2022075.1391000             0.10144874011E-04      
  2 303044.6556800              0.78783500963E-04      
  3  69013.9384900              0.41380919674E-03      
  4  19559.2446150              0.17427571893E-02      
  5   6383.8934901              0.63004086126E-02      
  6   2305.3502858              0.20125347032E-01      
  7    899.14418101             0.56966060520E-01      
  8    372.59500133             0.13882654093    
  9    161.97635247             0.27132285414    
 10     73.085553853            0.36383620662    
 11     33.595644762            0.24724464776    
S   4
  1    685.49855365             0.44367463797E-02      
  2    211.66163373             0.42502718169E-01      
  3     80.851405131            0.18467742018    
  4     35.108667236            0.29353173891    
S   1
  1     14.409437283            1.0000000        
S   1
  1      6.8697147262           1.0000000        
S   1
  1      3.2121883687           1.0000000        
S   1
  1      1.2610484365           1.0000000        
S   1
  1      0.61438946301          1.0000000        
S   1
  1      0.27264370973          1.0000000        
S   1
  1      0.77173005207E-01            1.0000000        
S   1
  1      0.40918397569E-01            1.0000000        
S   1
  1      0.17055762425E-01            1.0000000        
P   9
  1   3469.6649718              0.21340225970E-03      
  2    822.02356107             0.18637844836E-02      
  3    266.58406636             0.10211431546E-01      
  4    101.28048161             0.40799604728E-01      
  5     42.429490761            0.12257473393    
  6     18.912083912            0.26405833679    
  7      8.7017779030           0.38227164575    
  8      4.0854567599           0.29998812383    
  9      1.8667286060           0.78007265591E-01      
P   5
  1     27.544639057           -0.58222994163E-02      
  2      9.2098893609          -0.26787531329E-01      
  3      1.7232877425           0.30666847665    
  4      0.77969303735          0.66927944165    
  5      0.34379047862          0.60376468615    
P   1
  1      0.14346681918          1.0000000        
P   1
  1      0.68000000000E-01            1.0000000        
P   1
  1      0.32000000000E-01            1.0000000        
P   1
  1      0.15300000000E-01            1.0000000        
D   1
  1      1.7000000000           1.0000000        
D   1
  1      0.51000000000          1.0000000        
D   1
  1      0.18000000000          1.0000000        
D   1
  1      0.54000000000E-01            1.0000000        
F   1
  1      2.3700000000           1.0000000        
F   1
  1      0.79000000000          1.0000000        
F   1
  1      0.90000000000E-01            1.0000000        


