# all_value

name: cc-pVTZ(fi/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   18
  1      7.4479668E+06          4.39921626068E-05      
  2      1.1153182E+06          1.63910511992E-04      
  3      2.5384265E+05          5.78426194834E-04      
  4      7.1915285E+04          1.89904528930E-03      
  5      2.3470181E+04          5.92603246033E-03      
  6      8.4774918E+03          1.73074516997E-02      
  7      3.3083908E+03          4.66695101077E-02      
  8      1.3726054E+03          1.12567220474E-01      
  9      5.9822007E+02          2.27896120933E-01      
 10      2.7138602E+02          3.41343011482E-01      
 11      1.2697795E+02          2.94530055995E-01      
 12      6.0222065E+01          9.40938951359E-02      
 13      2.8018582E+01          3.86067598215E-03      
 14      1.3517522E+01          9.65620577742E-04      
 15      6.3094060E+00         -4.54176318028E-04      
 16      2.9045340E+00          1.65536566138E-04      
 17      1.2875560E+00         -8.43531725781E-05      
 18      1.6773200E-01         -2.45220501041E-05      
S   18
  1      7.4479668E+06         -1.40427128671E-05      
  2      1.1153182E+06         -5.24779366094E-05      
  3      2.5384265E+05         -1.85867388370E-04      
  4      7.1915285E+04         -6.11797590334E-04      
  5      2.3470181E+04         -1.92059146170E-03      
  6      8.4774918E+03         -5.65289563464E-03      
  7      3.3083908E+03         -1.55988453912E-02      
  8      1.3726054E+03         -3.93051476243E-02      
  9      5.9822007E+02         -8.82105318339E-02      
 10      2.7138602E+02         -1.60803933148E-01      
 11      1.2697795E+02         -1.96400633231E-01      
 12      6.0222065E+01         -4.23387427342E-03      
 13      2.8018582E+01          4.72492596053E-01      
 14      1.3517522E+01          5.39483732529E-01      
 15      6.3094060E+00          1.27787567336E-01      
 16      2.9045340E+00          1.89496724036E-03      
 17      1.2875560E+00          1.89142191978E-03      
 18      1.6773200E-01          2.86651424796E-04      
S   18
  1      7.4479668E+06          5.43252555575E-06      
  2      1.1153182E+06          2.03102894746E-05      
  3      2.5384265E+05          7.19596715994E-05      
  4      7.1915285E+04          2.36981915152E-04      
  5      2.3470181E+04          7.44303786796E-04      
  6      8.4774918E+03          2.19368380603E-03      
  7      3.3083908E+03          6.06818209839E-03      
  8      1.3726054E+03          1.53860431412E-02      
  9      5.9822007E+02          3.49652389523E-02      
 10      2.7138602E+02          6.55684396947E-02      
 11      1.2697795E+02          8.41195249168E-02      
 12      6.0222065E+01          1.15484543089E-03      
 13      2.8018582E+01         -2.87183632964E-01      
 14      1.3517522E+01         -4.90520594343E-01      
 15      6.3094060E+00          4.46645525365E-02      
 16      2.9045340E+00          7.31334410391E-01      
 17      1.2875560E+00          4.53667944021E-01      
 18      1.6773200E-01         -7.97422054220E-03      
S   18
  1      7.4479668E+06         -1.40322300146E-06      
  2      1.1153182E+06         -5.24799382865E-06      
  3      2.5384265E+05         -1.85844348789E-05      
  4      7.1915285E+04         -6.12613439135E-05      
  5      2.3470181E+04         -1.92176527059E-04      
  6      8.4774918E+03         -5.67473561903E-04      
  7      3.3083908E+03         -1.56682200265E-03      
  8      1.3726054E+03         -3.98737281948E-03      
  9      5.9822007E+02         -9.04382022102E-03      
 10      2.7138602E+02         -1.71150725609E-02      
 11      1.2697795E+02         -2.19036169472E-02      
 12      6.0222065E+01         -6.27542680183E-04      
 13      2.8018582E+01          7.99909721811E-02      
 14      1.3517522E+01          1.41328847767E-01      
 15      6.3094060E+00         -1.67130827214E-02      
 16      2.9045340E+00         -2.86249890949E-01      
 17      1.2875560E+00         -3.23024126406E-01      
 18      1.6773200E-01          6.00941921215E-01      
S   1
  1      3.3655200E-01          1.0000000        
S   1
  1      7.1069000E-02          1.0000000        
P   11
  1      6.9795982E+03          7.66787659379E-04      
  2      1.6541648E+03          4.70244693312E-03      
  3      5.3602865E+02          2.32197708716E-02      
  4      2.0353713E+02          8.51643525011E-02      
  5      8.5237530E+01          2.25875741353E-01      
  6      3.7841962E+01          3.90351294420E-01      
  7      1.7406512E+01          3.51154177620E-01      
  8      7.8814920E+00          1.04166499499E-01      
  9      3.5332130E+00          3.59351068138E-03      
 10      1.5214730E+00          1.84765328836E-03      
 11      1.9909300E-01          1.81263948847E-04      
P   11
  1      6.9795982E+03         -2.96530182528E-04      
  2      1.6541648E+03         -1.83096936717E-03      
  3      5.3602865E+02         -9.11570152602E-03      
  4      2.0353713E+02         -3.43996579845E-02      
  5      8.5237530E+01         -9.50151683521E-02      
  6      3.7841962E+01         -1.75795846921E-01      
  7      1.7406512E+01         -1.42201646020E-01      
  8      7.8814920E+00          1.93428550499E-01      
  9      3.5332130E+00          5.27453163767E-01      
 10      1.5214730E+00          3.90624981999E-01      
 11      1.9909300E-01         -2.99751425912E-03      
P   11
  1      6.9795982E+03          5.81890064037E-05      
  2      1.6541648E+03          3.58000335934E-04      
  3      5.3602865E+02          1.79353830803E-03      
  4      2.0353713E+02          6.74850233602E-03      
  5      8.5237530E+01          1.88600654881E-02      
  6      3.7841962E+01          3.48227135214E-02      
  7      1.7406512E+01          2.83562452554E-02      
  8      7.8814920E+00         -4.85595773630E-02      
  9      3.5332130E+00         -1.24452243546E-01      
 10      1.5214730E+00         -1.17983831508E-01      
 11      1.9909300E-01          5.53512960998E-01      
P   1
  1      5.6270400E-01          1.0000000        
P   1
  1      6.7031000E-02          1.0000000        
D   7
  1      2.8223911E+02          1.91622886028E-03      
  2      8.4549957E+01          1.52961803463E-02      
  3      3.2073656E+01          6.59016551110E-02      
  4      1.3497495E+01          1.82861092907E-01      
  5      5.9585500E+00          3.21362981265E-01      
  6      2.6107880E+00          3.71738974262E-01      
  7      1.1039870E+00          2.78005438433E-01      
D   1
  1      4.2404900E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      3.4580000E-01          1.0000000


name: cc-pVTZ(fi/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: As
data:
ARSENIC
S   18
  1      8.4823396E+06          4.39431698456E-05      
  2      1.2701509E+06          1.61135733268E-04      
  3      2.8905696E+05          5.58202126031E-04      
  4      8.1879849E+04          1.80546172954E-03      
  5      2.6716564E+04          5.57635031523E-03      
  6      9.6475842E+03          1.61893464563E-02      
  7      3.7641195E+03          4.35746066373E-02      
  8      1.5615656E+03          1.05481087833E-01      
  9      6.8081467E+02          2.16109188054E-01      
 10      3.0924119E+02          3.33012996735E-01      
 11      1.4525736E+02          3.05104642705E-01      
 12      6.9739048E+01          1.12035970744E-01      
 13      3.1770325E+01          7.46364634292E-03      
 14      1.5391757E+01          3.08221012616E-04      
 15      7.3415260E+00         -1.44466051639E-04      
 16      3.3237160E+00          2.06707230575E-05      
 17      1.4858670E+00         -3.35669207184E-05      
 18      2.1150000E-01         -8.58364252392E-06      
S   18
  1      8.4823396E+06         -1.40936310484E-05      
  2      1.2701509E+06         -5.18324306010E-05      
  3      2.8905696E+05         -1.80274651988E-04      
  4      8.1879849E+04         -5.84484985564E-04      
  5      2.6716564E+04         -1.81689943708E-03      
  6      9.6475842E+03         -5.31035618565E-03      
  7      3.7641195E+03         -1.46218864356E-02      
  8      1.5615656E+03         -3.68303895729E-02      
  9      6.8081467E+02         -8.32632133011E-02      
 10      3.0924119E+02         -1.53842879182E-01      
 11      1.4525736E+02         -1.98299595866E-01      
 12      6.9739048E+01         -3.42513223203E-02      
 13      3.1770325E+01          4.37523257784E-01      
 14      1.5391757E+01          5.58611563253E-01      
 15      7.3415260E+00          1.55533802170E-01      
 16      3.3237160E+00          4.99455227130E-03      
 17      1.4858670E+00          1.67752632412E-03      
 18      2.1150000E-01          2.28225420252E-04      
S   18
  1      8.4823396E+06          5.50965370269E-06      
  2      1.2701509E+06          2.02692607869E-05      
  3      2.8905696E+05          7.05404399643E-05      
  4      8.1879849E+04          2.28733055058E-04      
  5      2.6716564E+04          7.11796017041E-04      
  6      9.6475842E+03          2.08145681425E-03      
  7      3.7641195E+03          5.75058001836E-03      
  8      1.5615656E+03          1.45514494032E-02      
  9      6.8081467E+02          3.33469292163E-02      
 10      3.0924119E+02          6.31236393998E-02      
 11      1.4525736E+02          8.56591714537E-02      
 12      6.9739048E+01          1.47679380050E-02      
 13      3.1770325E+01         -2.62019193404E-01      
 14      1.5391757E+01         -5.01838077040E-01      
 15      7.3415260E+00         -1.95553100916E-02      
 16      3.3237160E+00          7.22967841987E-01      
 17      1.4858670E+00          4.93687236320E-01      
 18      2.1150000E-01         -8.77634652708E-03      
S   18
  1      8.4823396E+06         -1.52916707062E-06      
  2      1.2701509E+06         -5.62732052433E-06      
  3      2.8905696E+05         -1.95760931831E-05      
  4      8.1879849E+04         -6.35287351387E-05      
  5      2.6716564E+04         -1.97497045742E-04      
  6      9.6475842E+03         -5.78476409652E-04      
  7      3.7641195E+03         -1.59571333892E-03      
  8      1.5615656E+03         -4.05106553034E-03      
  9      6.8081467E+02         -9.27015892250E-03      
 10      3.0924119E+02         -1.76939803940E-02      
 11      1.4525736E+02         -2.39901511889E-02      
 12      6.9739048E+01         -4.48221690495E-03      
 13      3.1770325E+01          7.82688104897E-02      
 14      1.5391757E+01          1.55760553687E-01      
 15      7.3415260E+00          4.08255360475E-03      
 16      3.3237160E+00         -3.03629691186E-01      
 17      1.4858670E+00         -3.70773238636E-01      
 18      2.1150000E-01          6.30868951518E-01      
S   1
  1      4.2108600E-01          1.0000000        
S   1
  1      8.8974000E-02          1.0000000        
P   11
  1      7.4238614E+03          7.92771511291E-04      
  2      1.7595166E+03          4.78397997169E-03      
  3      5.7022916E+02          2.35131342473E-02      
  4      2.1657997E+02          8.60058901183E-02      
  5      9.0734252E+01          2.27658913490E-01      
  6      4.0308791E+01          3.91797103710E-01      
  7      1.8555502E+01          3.48933495253E-01      
  8      8.3965430E+00          1.01825765374E-01      
  9      3.7673670E+00          3.26884031276E-03      
 10      1.6297010E+00          1.77371288765E-03      
 11      2.2250300E-01          2.14186546128E-04      
P   11
  1      7.4238614E+03         -3.11204261718E-04      
  2      1.7595166E+03         -1.89133271168E-03      
  3      5.7022916E+02         -9.37263991077E-03      
  4      2.1657997E+02         -3.52929902328E-02      
  5      9.0734252E+01         -9.73189709230E-02      
  6      4.0308791E+01         -1.79531249358E-01      
  7      1.8555502E+01         -1.41498864549E-01      
  8      8.3965430E+00          2.04327784521E-01      
  9      3.7673670E+00          5.37678354563E-01      
 10      1.6297010E+00          3.78600644604E-01      
 11      2.2250300E-01         -4.67296421174E-03      
P   11
  1      7.4238614E+03          6.87180375142E-05      
  2      1.7595166E+03          4.18493968651E-04      
  3      5.7022916E+02          2.07263200661E-03      
  4      2.1657997E+02          7.84483011601E-03      
  5      9.0734252E+01          2.16886769731E-02      
  6      4.0308791E+01          4.05164085487E-02      
  7      1.8555502E+01          3.08517532449E-02      
  8      8.3965430E+00         -5.62117684357E-02      
  9      3.7673670E+00         -1.51102862030E-01      
 10      1.6297010E+00         -1.18979537979E-01      
 11      2.2250300E-01          5.48712502881E-01      
P   1
  1      5.6826300E-01          1.0000000        
P   1
  1      8.0405000E-02          1.0000000        
D   7
  1      3.2101961E+02          1.77828171932E-03      
  2      9.6249305E+01          1.43336966989E-02      
  3      3.6644963E+01          6.27704167241E-02      
  4      1.5493965E+01          1.77524263080E-01      
  5      6.8911380E+00          3.19554108918E-01      
  6      3.0548310E+00          3.76080764380E-01      
  7      1.3142410E+00          2.77841192550E-01      
D   1
  1      5.1343000E-01          1.0000000        
D   1
  1      1.8770000E-01          1.0000000        
F   1
  1      4.1580000E-01          1.0000000


name: cc-pVTZ(fi/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Se
data:
SELENIUM
S   18
  1      9.5636000E+06          4.41237232214E-05      
  2      1.4321000E+06          1.59780385652E-04      
  3      3.2591000E+05          5.43859385965E-04      
  4      9.2312000E+04          1.73389229414E-03      
  5      3.0116000E+04          5.30040886264E-03      
  6      1.0872000E+04          1.52953081139E-02      
  7      4.2401000E+03          4.10806897561E-02      
  8      1.7584000E+03          9.97087899833E-02      
  9      7.6659000E+02          2.06257838895E-01      
 10      3.4843000E+02          3.25230018199E-01      
 11      1.6403000E+02          3.13060320571E-01      
 12      7.9142000E+01          1.28032737987E-01      
 13      3.5524000E+01          1.08766124923E-02      
 14      1.7305000E+01         -3.13923119247E-04      
 15      8.3784000E+00          1.48918760539E-04      
 16      3.7405000E+00         -1.11412936753E-04      
 17      1.6890000E+00          1.89310728725E-05      
 18      2.5520000E-01          7.76302841169E-06      
S   18
  1      9.5636000E+06         -1.42166116567E-05      
  2      1.4321000E+06         -5.16328670027E-05      
  3      3.2591000E+05         -1.76495123716E-04      
  4      9.2312000E+04         -5.64025973459E-04      
  5      3.0116000E+04         -1.73585487717E-03      
  6      1.0872000E+04         -5.03939699902E-03      
  7      4.2401000E+03         -1.38401926952E-02      
  8      1.7584000E+03         -3.48495729293E-02      
  9      7.6659000E+02         -7.92228185467E-02      
 10      3.4843000E+02         -1.48055640609E-01      
 11      1.6403000E+02         -1.98790923433E-01      
 12      7.9142000E+01         -5.67290344675E-02      
 13      3.5524000E+01          4.06629343336E-01      
 14      1.7305000E+01          5.69866497752E-01      
 15      8.3784000E+00          1.81032143226E-01      
 16      3.7405000E+00          8.19346980436E-03      
 17      1.6890000E+00          1.37218297579E-03      
 18      2.5520000E-01          1.49608414041E-04      
S   18
  1      9.5636000E+06          5.61514455993E-06      
  2      1.4321000E+06          2.03980044839E-05      
  3      3.2591000E+05          6.97834428435E-05      
  4      9.2312000E+04          2.22970701460E-04      
  5      3.0116000E+04          6.87276510760E-04      
  6      1.0872000E+04          1.99496115190E-03      
  7      4.2401000E+03          5.50137303668E-03      
  8      1.7584000E+03          1.38981320612E-02      
  9      7.6659000E+02          3.20525490430E-02      
 10      3.4843000E+02          6.11745874518E-02      
 11      1.6403000E+02          8.65932787845E-02      
 12      7.9142000E+01          2.50466428888E-02      
 13      3.5524000E+01         -2.41592130351E-01      
 14      1.7305000E+01         -5.07122574966E-01      
 15      8.3784000E+00         -7.01287732042E-02      
 16      3.7405000E+00          7.12713524758E-01      
 17      1.6890000E+00          5.23904133026E-01      
 18      2.5520000E-01         -9.06466534782E-03      
S   18
  1      9.5636000E+06         -1.64887855226E-06      
  2      1.4321000E+06         -5.99167513496E-06      
  3      3.2591000E+05         -2.04900410530E-05      
  4      9.2312000E+04         -6.55225163601E-05      
  5      3.0116000E+04         -2.01763160452E-04      
  6      1.0872000E+04         -5.86623355479E-04      
  7      4.2401000E+03         -1.61516276360E-03      
  8      1.7584000E+03         -4.09376997821E-03      
  9      7.6659000E+02         -9.42716910708E-03      
 10      3.4843000E+02         -1.81410308316E-02      
 11      1.6403000E+02         -2.56623014299E-02      
 12      7.9142000E+01         -7.82154183612E-03      
 13      3.5524000E+01          7.63676571275E-02      
 14      1.7305000E+01          1.66652065890E-01      
 15      8.3784000E+00          2.30840263474E-02      
 16      3.7405000E+00         -3.18286974709E-01      
 17      1.6890000E+00         -4.10907714890E-01      
 18      2.5520000E-01          6.57989252241E-01      
S   1
  1      5.0927000E-01          1.0000000        
S   1
  1      1.0651000E-01          1.0000000        
P   11
  1      8.0043000E+03          8.02399911142E-04      
  2      1.8969000E+03          4.75167660723E-03      
  3      6.1471000E+02          2.32604404341E-02      
  4      2.3350000E+02          8.50670154371E-02      
  5      9.7856000E+01          2.25852539243E-01      
  6      4.3514000E+01          3.90512936396E-01      
  7      2.0063000E+01          3.50322864820E-01      
  8      9.1127000E+00          1.04006994167E-01      
  9      4.1063000E+00          3.57854365094E-03      
 10      1.7949000E+00          1.72348215110E-03      
 11      2.4615000E-01          2.05757564518E-04      
P   11
  1      8.0043000E+03         -3.19613621085E-04      
  2      1.8969000E+03         -1.90589275951E-03      
  3      6.1471000E+02         -9.40951885538E-03      
  4      2.3350000E+02         -3.54142700959E-02      
  5      9.7856000E+01         -9.80038547892E-02      
  6      4.3514000E+01         -1.81591546191E-01      
  7      2.0063000E+01         -1.44711325633E-01      
  8      9.1127000E+00          2.03234964506E-01      
  9      4.1063000E+00          5.41983910927E-01      
 10      1.7949000E+00          3.76052890291E-01      
 11      2.4615000E-01         -4.46083027423E-03      
P   11
  1      8.0043000E+03          7.69972951720E-05      
  2      1.8969000E+03          4.61233415418E-04      
  3      6.1471000E+02          2.26894180664E-03      
  4      2.3350000E+02          8.61503296483E-03      
  5      9.7856000E+01          2.38100365309E-02      
  6      4.3514000E+01          4.49771896425E-02      
  7      2.0063000E+01          3.40280633464E-02      
  8      9.1127000E+00         -6.07249405175E-02      
  9      4.1063000E+00         -1.71692010610E-01      
 10      1.7949000E+00         -1.23714862301E-01      
 11      2.4615000E-01          5.67377259729E-01      
P   1
  1      6.2432000E-01          1.0000000        
P   1
  1      8.8917000E-02          1.0000000        
D   7
  1      3.6185000E+02          1.66488522610E-03      
  2      1.0855000E+02          1.35303290082E-02      
  3      4.1433000E+01          6.01695777010E-02      
  4      1.7579000E+01          1.73132892368E-01      
  5      7.8627000E+00          3.18150934330E-01      
  6      3.5180000E+00          3.79851590077E-01      
  7      1.5348000E+00          2.77311593099E-01      
D   1
  1      6.0813000E-01          1.0000000        
D   1
  1      2.2200000E-01          1.0000000        
F   1
  1      4.6200000E-01          1.0000000


name: cc-pVTZ(fi/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Br
data:
BROMINE
S   18
  1      1.0639000E+07          4.48033680689E-05      
  2      1.5934000E+06          1.60241390269E-04      
  3      3.6261000E+05          5.36759624421E-04      
  4      1.0270000E+05          1.68800608412E-03      
  5      3.3501000E+04          5.10825219802E-03      
  6      1.2093000E+04          1.46435709876E-02      
  7      4.7159000E+03          3.92075144513E-02      
  8      1.9556000E+03          9.52601830566E-02      
  9      8.5261000E+02          1.98439842471E-01      
 10      3.8767000E+02          3.18545002609E-01      
 11      1.8268000E+02          3.18786301333E-01      
 12      8.8245000E+01          1.41166036853E-01      
 13      3.9263000E+01          1.38787618671E-02      
 14      1.9234000E+01         -8.38780919397E-04      
 15      9.4057000E+00          3.96069440784E-04      
 16      4.1601000E+00         -2.21565840700E-04      
 17      1.8995000E+00          6.73752628867E-05      
 18      3.0114000E-01          2.19242668995E-05      
S   18
  1      1.0639000E+07         -1.45002167822E-05      
  2      1.5934000E+06         -5.20155796137E-05      
  3      3.6261000E+05         -1.75009715870E-04      
  4      1.0270000E+05         -5.51731895182E-04      
  5      3.3501000E+04         -1.68126905361E-03      
  6      1.2093000E+04         -4.84693885098E-03      
  7      4.7159000E+03         -1.32639373268E-02      
  8      1.9556000E+03         -3.33616584494E-02      
  9      8.5261000E+02         -7.61093556135E-02      
 10      3.8767000E+02         -1.43559677162E-01      
 11      1.8268000E+02         -1.98641139105E-01      
 12      8.8245000E+01         -7.32199910628E-02      
 13      3.9263000E+01          3.80741462936E-01      
 14      1.9234000E+01          5.76141895909E-01      
 15      9.4057000E+00          2.03171081558E-01      
 16      4.1601000E+00          1.12013616683E-02      
 17      1.8995000E+00          1.04153356024E-03      
 18      3.0114000E-01          7.11779733470E-05      
S   18
  1      1.0639000E+07          5.78436805978E-06      
  2      1.5934000E+06          2.07533694759E-05      
  3      3.6261000E+05          6.98936282519E-05      
  4      1.0270000E+05          2.20270535842E-04      
  5      3.3501000E+04          6.72469010701E-04      
  6      1.2093000E+04          1.93754255831E-03      
  7      4.7159000E+03          5.32647916942E-03      
  8      1.9556000E+03          1.34292310757E-02      
  9      8.5261000E+02          3.10971613010E-02      
 10      3.8767000E+02          5.97685341921E-02      
 11      1.8268000E+02          8.72451068700E-02      
 12      8.8245000E+01          3.27437551400E-02      
 13      3.9263000E+01         -2.25596016010E-01      
 14      1.9234000E+01         -5.09370058584E-01      
 15      9.4057000E+00         -1.10252325177E-01      
 16      4.1601000E+00          7.02131380635E-01      
 17      1.8995000E+00          5.47305538901E-01      
 18      3.0114000E-01         -8.97143483336E-03      
S   18
  1      1.0639000E+07         -1.77789217904E-06      
  2      1.5934000E+06         -6.38074638409E-06      
  3      3.6261000E+05         -2.14810069421E-05      
  4      1.0270000E+05         -6.77527479437E-05      
  5      3.3501000E+04         -2.06638659418E-04      
  6      1.2093000E+04         -5.96363714885E-04      
  7      4.7159000E+03         -1.63685798628E-03      
  8      1.9556000E+03         -4.14052945453E-03      
  9      8.5261000E+02         -9.57316358479E-03      
 10      3.8767000E+02         -1.85513381684E-02      
 11      1.8268000E+02         -2.70661067978E-02      
 12      8.8245000E+01         -1.06042796279E-02      
 13      3.9263000E+01          7.46998616512E-02      
 14      1.9234000E+01          1.75322648278E-01      
 15      9.4057000E+00          3.98213870984E-02      
 16      4.1601000E+00         -3.30421332384E-01      
 17      1.8995000E+00         -4.45929257581E-01      
 18      3.0114000E-01          6.80840177373E-01      
S   1
  1      6.0472000E-01          1.0000000        
S   1
  1      1.2515000E-01          1.0000000        
P   11
  1      8.6765000E+03          8.04707026418E-04      
  2      2.0559000E+03          4.66802041957E-03      
  3      6.6623000E+02          2.27570039443E-02      
  4      2.5310000E+02          8.32783115161E-02      
  5      1.0612000E+02          2.22238106012E-01      
  6      4.7242000E+01          3.87780617816E-01      
  7      2.1825000E+01          3.53455062379E-01      
  8      9.9684000E+00          1.08524453064E-01      
  9      4.5171000E+00          4.22742811224E-03      
 10      1.9982000E+00          1.69576884653E-03      
 11      2.8145000E-01          1.98057355078E-04      
P   11
  1      8.6765000E+03         -3.25045645238E-04      
  2      2.0559000E+03         -1.89811932255E-03      
  3      6.6623000E+02         -9.33623173898E-03      
  4      2.5310000E+02         -3.51354272736E-02      
  5      1.0612000E+02         -9.77905446454E-02      
  6      4.7242000E+01         -1.82686206082E-01      
  7      2.1825000E+01         -1.49869872192E-01      
  8      9.9684000E+00          1.95940742043E-01      
  9      4.5171000E+00          5.43365597264E-01      
 10      1.9982000E+00          3.79129745292E-01      
 11      2.8145000E-01         -4.03660637719E-03      
P   11
  1      8.6765000E+03          8.38412616436E-05      
  2      2.0559000E+03          4.92214233818E-04      
  3      6.6623000E+02          2.41002520484E-03      
  4      2.5310000E+02          9.16172375022E-03      
  5      1.0612000E+02          2.54374767172E-02      
  6      4.7242000E+01          4.85650675803E-02      
  7      2.1825000E+01          3.76938629245E-02      
  8      9.9684000E+00         -6.30859383872E-02      
  9      4.5171000E+00         -1.87896306985E-01      
 10      1.9982000E+00         -1.31854500166E-01      
 11      2.8145000E-01          5.72347022203E-01      
P   1
  1      7.0988000E-01          1.0000000        
P   1
  1      1.0204000E-01          1.0000000        
D   7
  1      4.0383000E+02          1.57821218900E-03      
  2      1.2117000E+02          1.29051969924E-02      
  3      4.6345000E+01          5.81344278648E-02      
  4      1.9721000E+01          1.69695114608E-01      
  5      8.8624000E+00          3.17171771567E-01      
  6      3.9962000E+00          3.83075081767E-01      
  7      1.7636000E+00          2.76409819912E-01      
D   1
  1      7.0619000E-01          1.0000000        
D   1
  1      2.6390000E-01          1.0000000        
F   1
  1      5.5150000E-01          1.0000000


name: cc-pVTZ(fi/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   18
  1      1.1718113E+07          4.56884707558E-05      
  2      1.7546044E+06          1.62085692902E-04      
  3      3.9928132E+05          5.34765683170E-04      
  4      1.1308457E+05          1.66016211742E-03      
  5      3.6885925E+04          4.97499910891E-03      
  6      1.3312209E+04          1.41702369561E-02      
  7      5.1899883E+03          3.78169824706E-02      
  8      2.1516597E+03          9.18891510312E-02      
  9      9.3803251E+02          1.92359365704E-01      
 10      4.2655732E+02          3.13007093814E-01      
 11      2.0106660E+02          3.22813195617E-01      
 12      9.7097605E+01          1.51650477638E-01      
 13      4.2998724E+01          1.64509944878E-02      
 14      2.1177075E+01         -1.25749980847E-03      
 15      1.0426752E+01          5.92607084012E-04      
 16      4.5850080E+00         -3.10321967528E-04      
 17      2.1176030E+00          1.10023926729E-04      
 18      3.4922500E-01          3.32985703603E-05      
S   18
  1      1.1718113E+07         -1.48513659850E-05      
  2      1.7546044E+06         -5.28471338676E-05      
  3      3.9928132E+05         -1.75158285701E-04      
  4      1.1308457E+05         -5.45200221020E-04      
  5      3.6885925E+04         -1.64540895562E-03      
  6      1.3312209E+04         -4.71231282922E-03      
  7      5.1899883E+03         -1.28483148749E-02      
  8      2.1516597E+03         -3.22693090430E-02      
  9      9.3803251E+02         -7.37711773911E-02      
 10      4.2655732E+02         -1.40144371191E-01      
 11      2.0106660E+02         -1.98253605368E-01      
 12      9.7097605E+01         -8.53641575137E-02      
 13      4.2998724E+01          3.59433178237E-01      
 14      2.1177075E+01          5.79363489041E-01      
 15      1.0426752E+01          2.22028578434E-01      
 16      4.5850080E+00          1.39182505633E-02      
 17      2.1176030E+00          7.20691571037E-04      
 18      3.4922500E-01          2.91058361163E-06      
S   18
  1      1.1718113E+07          5.98119365753E-06      
  2      1.7546044E+06          2.12864574324E-05      
  3      3.9928132E+05          7.06279385694E-05      
  4      1.1308457E+05          2.19739864640E-04      
  5      3.6885925E+04          6.64553466988E-04      
  6      1.3312209E+04          1.90156525871E-03      
  7      5.1899883E+03          5.21020312587E-03      
  8      2.1516597E+03          1.31085621312E-02      
  9      9.3803251E+02          3.04287501683E-02      
 10      4.2655732E+02          5.88076672335E-02      
 11      2.0106660E+02          8.77917817177E-02      
 12      9.7097605E+01          3.85604470679E-02      
 13      4.2998724E+01         -2.13126320514E-01      
 14      2.1177075E+01         -5.10324640321E-01      
 15      1.0426752E+01         -1.42506171637E-01      
 16      4.5850080E+00          6.92522156439E-01      
 17      2.1176030E+00          5.65432535516E-01      
 18      3.4922500E-01         -8.60639008443E-03      
S   18
  1      1.1718113E+07         -1.90947972766E-06      
  2      1.7546044E+06         -6.79773874075E-06      
  3      3.9928132E+05         -2.25463500508E-05      
  4      1.1308457E+05         -7.02041684183E-05      
  5      3.6885925E+04         -2.12107005579E-04      
  6      1.3312209E+04         -6.07942033427E-04      
  7      5.1899883E+03         -1.66306709979E-03      
  8      2.1516597E+03         -4.19813305832E-03      
  9      9.3803251E+02         -9.72970197774E-03      
 10      4.2655732E+02         -1.89593589395E-02      
 11      2.0106660E+02         -2.82928582319E-02      
 12      9.7097605E+01         -1.29156407718E-02      
 13      4.2998724E+01          7.33854224443E-02      
 14      2.1177075E+01          1.82579093608E-01      
 15      1.0426752E+01          5.45392369242E-02      
 16      4.5850080E+00         -3.41112016456E-01      
 17      2.1176030E+00         -4.76711778773E-01      
 18      3.4922500E-01          7.00136162358E-01      
S   1
  1      7.0705700E-01          1.0000000        
S   1
  1      1.4482100E-01          1.0000000        
P   11
  1      9.3663090E+03          8.10074991781E-04      
  2      2.2195543E+03          4.60232426854E-03      
  3      7.1945288E+02          2.23222091233E-02      
  4      2.7346446E+02          8.16406820488E-02      
  5      1.1475225E+02          2.18759561867E-01      
  6      5.1155569E+01          3.84926100496E-01      
  7      2.3682676E+01          3.56323728619E-01      
  8      1.0875484E+01          1.13030989904E-01      
  9      4.9551310E+00          4.91481643612E-03      
 10      2.2172670E+00          1.66360761351E-03      
 11      3.2215400E-01          2.04755486925E-04      
P   11
  1      9.3663090E+03         -3.31715076224E-04      
  2      2.2195543E+03         -1.89663718806E-03      
  3      7.1945288E+02         -9.28484167312E-03      
  4      2.7346446E+02         -3.48986469186E-02      
  5      1.1475225E+02         -9.75820830279E-02      
  6      5.1155569E+01         -1.83671076197E-01      
  7      2.3682676E+01         -1.54882716270E-01      
  8      1.0875484E+01          1.88682147088E-01      
  9      4.9551310E+00          5.44519041314E-01      
 10      2.2172670E+00          3.82537247731E-01      
 11      3.2215400E-01         -4.43819305026E-03      
P   11
  1      9.3663090E+03          8.98586331302E-05      
  2      2.2195543E+03          5.16751938627E-04      
  3      7.1945288E+02          2.51696150525E-03      
  4      2.7346446E+02          9.56396853214E-03      
  5      1.1475225E+02          2.66637383470E-02      
  6      5.1155569E+01          5.13709737888E-02      
  7      2.3682676E+01          4.09435147771E-02      
  8      1.0875484E+01         -6.44091326593E-02      
  9      4.9551310E+00         -2.01170156561E-01      
 10      2.2172670E+00         -1.38997457095E-01      
 11      3.2215400E-01          5.72477999255E-01      
P   1
  1      8.0641000E-01          1.0000000        
P   1
  1      1.1761900E-01          1.0000000        
D   7
  1      4.4616133E+02          1.51553307956E-03      
  2      1.3396477E+02          1.24326980264E-02      
  3      5.1345907E+01          5.65533896965E-02      
  4      2.1916906E+01          1.66911854746E-01      
  5      9.8937250E+00          3.16320387242E-01      
  6      4.4925270E+00          3.85767780846E-01      
  7      2.0022930E+00          2.75372256551E-01      
D   1
  1      8.0840900E-01          1.0000000        
D   1
  1      3.0060000E-01          1.0000000        
F   1
  1      6.6220000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: H
data:
HYDROGEN
S   3
  1      3.3870000E+01          6.06899476480E-03      
  2      5.0950000E+00          4.53159259356E-02      
  3      1.1590000E+00          2.02834807411E-01      
S   1
  1      3.2580000E-01          1.0000000        
S   1
  1      1.0270000E-01          1.0000000        
P   1
  1      1.4070000E+00          1.0000000        
P   1
  1      3.8800000E-01          1.0000000        
D   1
  1      1.0570000E+00          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      2.3400000E+02          2.58661763795E-03      
  2      3.5160000E+01          1.95501733536E-02      
  3      7.9890000E+00          9.10301933510E-02      
  4      2.2120000E+00          2.72073369511E-01      
S   1
  1      6.6690000E-01          1.0000000        
S   1
  1      2.0890000E-01          1.0000000        
P   1
  1      3.0440000E+00          1.0000000        
P   1
  1      7.5800000E-01          1.0000000        
D   1
  1      1.9650000E+00          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: B
data:
BORON
S   8
  1      5.4730000E+03          5.31194753186E-04      
  2      8.2090000E+02          4.31512939382E-03      
  3      1.8680000E+02          2.20624711722E-02      
  4      5.2830000E+01          8.46536459055E-02      
  5      1.7080000E+01          2.38758698304E-01      
  6      5.9990000E+00          4.35018905462E-01      
  7      2.2080000E+00          3.41662417872E-01      
  8      2.4150000E-01         -9.53095660961E-03      
S   8
  1      5.4730000E+03         -1.06520750972E-04      
  2      8.2090000E+02         -8.72753336713E-04      
  3      1.8680000E+02         -4.50793803492E-03      
  4      5.2830000E+01         -1.77383447876E-02      
  5      1.7080000E+01         -5.37089801276E-02      
  6      5.9990000E+00         -1.19072710705E-01      
  7      2.2080000E+00         -1.65666017640E-01      
  8      2.4150000E-01          5.95994159002E-01      
S   1
  1      5.8790000E-01          1.0000000        
S   1
  1      8.6100000E-02          1.0000000        
P   3
  1      1.2050000E+01          1.31366582994E-02      
  2      2.6130000E+00          7.99033932450E-02      
  3      7.4750000E-01          2.77235199133E-01      
P   1
  1      2.3850000E-01          1.0000000        
P   1
  1      7.6980000E-02          1.0000000        
D   1
  1      6.6100000E-01          1.0000000        
D   1
  1      1.9900000E-01          1.0000000        
F   1
  1      4.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: C
data:
CARBON
S   8
  1      8.2360000E+03          5.06044594058E-04      
  2      1.2350000E+03          4.13969062334E-03      
  3      2.8080000E+02          2.12477522689E-02      
  4      7.9270000E+01          8.21643491797E-02      
  5      2.5590000E+01          2.35127803133E-01      
  6      8.9970000E+00          4.34373682112E-01      
  7      3.3190000E+00          3.45695570806E-01      
  8      3.6430000E-01         -8.96081581395E-03      
S   8
  1      8.2360000E+03         -1.06952305034E-04      
  2      1.2350000E+03         -8.86138430309E-04      
  3      2.8080000E+02         -4.58708178665E-03      
  4      7.9270000E+01         -1.82616824100E-02      
  5      2.5590000E+01         -5.60110019606E-02      
  6      8.9970000E+00         -1.27340183204E-01      
  7      3.3190000E+00         -1.70629633576E-01      
  8      3.6430000E-01          6.00775898561E-01      
S   1
  1      9.0590000E-01          1.0000000        
S   1
  1      1.2850000E-01          1.0000000        
P   3
  1      1.8710000E+01          1.39637202288E-02      
  2      4.1330000E+00          8.64436359746E-02      
  3      1.2000000E+00          2.87341600616E-01      
P   1
  1      3.8270000E-01          1.0000000        
P   1
  1      1.2090000E-01          1.0000000        
D   1
  1      1.0970000E+00          1.0000000        
D   1
  1      3.1800000E-01          1.0000000        
F   1
  1      7.6100000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: N
data:
NITROGEN
S   8
  1      1.1420000E+04          5.00654901663E-04      
  2      1.7120000E+03          4.08832957010E-03      
  3      3.8930000E+02          2.09923827472E-02      
  4      1.1000000E+02          8.11553523800E-02      
  5      3.5570000E+01          2.33514817461E-01      
  6      1.2540000E+01          4.33496965989E-01      
  7      4.6440000E+00          3.46874595418E-01      
  8      5.1180000E-01         -8.48004707452E-03      
S   8
  1      1.1420000E+04         -1.09391892065E-04      
  2      1.7120000E+03         -9.07404954762E-04      
  3      3.8930000E+02         -4.69654931576E-03      
  4      1.1000000E+02         -1.87374062459E-02      
  5      3.5570000E+01         -5.77862785059E-02      
  6      1.2540000E+01         -1.32929682227E-01      
  7      4.6440000E+00         -1.73198470505E-01      
  8      5.1180000E-01          6.03923879228E-01      
S   1
  1      1.2930000E+00          1.0000000        
S   1
  1      1.7870000E-01          1.0000000        
P   3
  1      2.6630000E+01          1.45822509694E-02      
  2      5.9480000E+00          9.12332893374E-02      
  3      1.7420000E+00          2.94467171768E-01      
P   1
  1      5.5500000E-01          1.0000000        
P   1
  1      1.7250000E-01          1.0000000        
D   1
  1      1.6540000E+00          1.0000000        
D   1
  1      4.6900000E-01          1.0000000        
F   1
  1      1.0930000E+00          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: O
data:
OXYGEN
S   8
  1      1.5330000E+04          4.92019911755E-04      
  2      2.2990000E+03          3.98535589227E-03      
  3      5.2240000E+02          2.05202983557E-02      
  4      1.4730000E+02          7.97335421258E-02      
  5      4.7550000E+01          2.31264146253E-01      
  6      1.6760000E+01          4.33030492121E-01      
  7      6.2070000E+00          3.49467757290E-01      
  8      6.8820000E-01         -8.12269288138E-03      
S   8
  1      1.5330000E+04         -1.10029098292E-04      
  2      2.2990000E+03         -9.07563140606E-04      
  3      5.2240000E+02         -4.70869075552E-03      
  4      1.4730000E+02         -1.89114307580E-02      
  5      4.7550000E+01         -5.87681807440E-02      
  6      1.6760000E+01         -1.36870855847E-01      
  7      6.2070000E+00         -1.75495578932E-01      
  8      6.8820000E-01          6.04377921629E-01      
S   1
  1      1.7520000E+00          1.0000000        
S   1
  1      2.3840000E-01          1.0000000        
P   3
  1      3.4460000E+01          1.59821683392E-02      
  2      7.7490000E+00          9.97341554075E-02      
  3      2.2800000E+00          3.09599276897E-01      
P   1
  1      7.1560000E-01          1.0000000        
P   1
  1      2.1400000E-01          1.0000000        
D   1
  1      2.3140000E+00          1.0000000        
D   1
  1      6.4500000E-01          1.0000000        
F   1
  1      1.4280000E+00          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: F
data:
FLUORINE
S   8
  1      1.9500000E+04          5.01343691800E-04      
  2      2.9230000E+03          3.99834213355E-03      
  3      6.6450000E+02          2.05503815532E-02      
  4      1.8750000E+02          7.97094737420E-02      
  5      6.0620000E+01          2.31174154976E-01      
  6      2.1420000E+01          4.32734922848E-01      
  7      7.9500000E+00          3.48952100525E-01      
  8      8.8150000E-01         -7.85256190802E-03      
S   8
  1      1.9500000E+04         -1.14066844899E-04      
  2      2.9230000E+03         -9.28142275772E-04      
  3      6.6450000E+02         -4.80516350084E-03      
  4      1.8750000E+02         -1.93024877077E-02      
  5      6.0620000E+01         -5.99685352136E-02      
  6      2.1420000E+01         -1.40327109690E-01      
  7      7.9500000E+00         -1.76111401710E-01      
  8      8.8150000E-01          6.05025296253E-01      
S   1
  1      2.2570000E+00          1.0000000        
S   1
  1      3.0410000E-01          1.0000000        
P   3
  1      4.3880000E+01          1.67785096739E-02      
  2      9.9260000E+00          1.04627364316E-01      
  3      2.9300000E+00          3.17294506997E-01      
P   1
  1      9.1320000E-01          1.0000000        
P   1
  1      2.6720000E-01          1.0000000        
D   1
  1      3.1070000E+00          1.0000000        
D   1
  1      8.5500000E-01          1.0000000        
F   1
  1      1.9170000E+00          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ne
data:
NEON
S   8
  1      2.4350000E+04          5.09188916073E-04      
  2      3.6500000E+03          3.97986628389E-03      
  3      8.2960000E+02          2.04265766961E-02      
  4      2.3400000E+02          7.92831222671E-02      
  5      7.5610000E+01          2.30595642116E-01      
  6      2.6730000E+01          4.32554650162E-01      
  7      9.9270000E+00          3.49384112187E-01      
  8      1.1020000E+00         -7.59756701546E-03      
S   8
  1      2.4350000E+04         -1.17434475705E-04      
  2      3.6500000E+03         -9.37546749340E-04      
  3      8.2960000E+02         -4.84649693400E-03      
  4      2.3400000E+02         -1.95063612377E-02      
  5      7.5610000E+01         -6.07699891945E-02      
  6      2.6730000E+01         -1.42912351961E-01      
  7      9.9270000E+00         -1.76854008118E-01      
  8      1.1020000E+00          6.05796214982E-01      
S   1
  1      2.8360000E+00          1.0000000        
S   1
  1      3.7820000E-01          1.0000000        
P   3
  1      5.4700000E+01          1.72998769376E-02      
  2      1.2430000E+01          1.07868085941E-01      
  3      3.6790000E+00          3.21736276330E-01      
P   1
  1      1.1430000E+00          1.0000000        
P   1
  1      3.3000000E-01          1.0000000        
D   1
  1      4.0140000E+00          1.0000000        
D   1
  1      1.0960000E+00          1.0000000        
F   1
  1      2.5440000E+00          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   13
  1      2.0550000E+05          9.61850845677E-05      
  2      3.0780000E+04          5.64131459248E-04      
  3      7.0060000E+03          2.90532179897E-03      
  4      1.9850000E+03          1.19426188134E-02      
  5      6.4910000E+02          4.08225197373E-02      
  6      2.3500000E+02          1.16496354529E-01      
  7      9.1620000E+01          2.61962874417E-01      
  8      3.7670000E+01          3.95641480034E-01      
  9      1.5910000E+01          2.82741174508E-01      
 10      5.8500000E+00          4.39902621683E-02      
 11      2.5420000E+00         -4.85492023127E-03      
 12      1.0570000E+00          2.58592505685E-03      
 13      1.4550000E-01          7.14262095258E-04      
S   13
  1      2.0550000E+05         -2.43420076505E-05      
  2      3.0780000E+04         -1.44986543795E-04      
  3      7.0060000E+03         -7.52985313958E-04      
  4      1.9850000E+03         -3.14421928021E-03      
  5      6.4910000E+02         -1.09131742801E-02      
  6      2.3500000E+02         -3.27137515009E-02      
  7      9.1620000E+01         -8.10150783582E-02      
  8      3.7670000E+01         -1.57217117394E-01      
  9      1.5910000E+01         -1.66772619041E-01      
 10      5.8500000E+00          1.30107807307E-01      
 11      2.5420000E+00          5.62015323323E-01      
 12      1.0570000E+00          4.33674099496E-01      
 13      1.4550000E-01         -1.10659713382E-02      
S   13
  1      2.0550000E+05          5.63235959851E-06      
  2      3.0780000E+04          3.34922633698E-05      
  3      7.0060000E+03          1.74048278959E-04      
  4      1.9850000E+03          7.25972139940E-04      
  5      6.4910000E+02          2.52713282518E-03      
  6      2.3500000E+02          7.58420226908E-03      
  7      9.1620000E+01          1.89889270406E-02      
  8      3.7670000E+01          3.74027689609E-02      
  9      1.5910000E+01          4.15103339758E-02      
 10      5.8500000E+00         -3.62703464277E-02      
 11      2.5420000E+00         -1.75977354638E-01      
 12      1.0570000E+00         -2.74773261748E-01      
 13      1.4550000E-01          6.52078079627E-01      
S   1
  1      2.9310000E-01          1.0000000        
S   1
  1      5.6500000E-02          1.0000000        
P   7
  1      4.4440000E+02          1.71258622489E-03      
  2      1.0510000E+02          1.32734069483E-02      
  3      3.3470000E+01          6.16376140684E-02      
  4      1.2330000E+01          1.88246961686E-01      
  5      4.8690000E+00          3.60455328396E-01      
  6      1.9610000E+00          4.08063539225E-01      
  7      1.8880000E-01          9.79073281935E-03      
P   7
  1      4.4440000E+02         -3.01021285358E-04      
  2      1.0510000E+02         -2.45927062097E-03      
  3      3.3470000E+01         -1.09305625705E-02      
  4      1.2330000E+01         -3.64735030254E-02      
  5      4.8690000E+00         -6.40362462811E-02      
  6      1.9610000E+00         -9.70648469061E-02      
  7      1.8880000E-01          5.02695283027E-01      
P   1
  1      7.8340000E-01          1.0000000        
P   1
  1      5.5570000E-02          1.0000000        
D   1
  1      3.3300000E-01          1.0000000        
D   1
  1      1.0900000E-01          1.0000000        
F   1
  1      2.4400000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Si
data:
SILICON
S   13
  1      2.5490000E+05          9.93890866590E-05      
  2      3.8190000E+04          5.40293243430E-04      
  3      8.6900000E+03          2.71268777372E-03      
  4      2.4620000E+03          1.11042907675E-02      
  5      8.0480000E+02          3.79963342572E-02      
  6      2.9130000E+02          1.09147174964E-01      
  7      1.1360000E+02          2.49271594256E-01      
  8      4.6750000E+01          3.90248342185E-01      
  9      1.9820000E+01          2.99847524034E-01      
 10      7.7080000E+00          5.52573893453E-02      
 11      3.3400000E+00         -3.98448642178E-03      
 12      1.4020000E+00          2.54814984850E-03      
 13      2.0700000E-01          5.99975033865E-04      
S   13
  1      2.5490000E+05         -2.59286248815E-05      
  2      3.8190000E+04         -1.41976339953E-04      
  3      8.6900000E+03         -7.20601822988E-04      
  4      2.4620000E+03         -2.98920123494E-03      
  5      8.0480000E+02         -1.04106583392E-02      
  6      2.9130000E+02         -3.12409386966E-02      
  7      1.1360000E+02         -7.85752382172E-02      
  8      4.6750000E+01         -1.54774206192E-01      
  9      1.9820000E+01         -1.78751919536E-01      
 10      7.7080000E+00          8.35452692033E-02      
 11      3.3400000E+00          5.48694038582E-01      
 12      1.4020000E+00          4.76611999592E-01      
 13      2.0700000E-01         -1.03286502646E-02      
S   13
  1      2.5490000E+05          6.67211356438E-06      
  2      3.8190000E+04          3.64234365724E-05      
  3      8.6900000E+03          1.85145508935E-04      
  4      2.4620000E+03          7.66917449753E-04      
  5      8.0480000E+02          2.67903487922E-03      
  6      2.9130000E+02          8.05060101686E-03      
  7      1.1360000E+02          2.04699256129E-02      
  8      4.6750000E+01          4.09639575088E-02      
  9      1.9820000E+01          4.95294109563E-02      
 10      7.7080000E+00         -2.60810413279E-02      
 11      3.3400000E+00         -1.91864142944E-01      
 12      1.4020000E+00         -3.17421883389E-01      
 13      2.0700000E-01          6.81676087906E-01      
S   1
  1      4.3870000E-01          1.0000000        
S   1
  1      7.9440000E-02          1.0000000        
P   7
  1      4.8150000E+02          2.03124711947E-03      
  2      1.1390000E+02          1.56236855921E-02      
  3      3.6230000E+01          7.19219025743E-02      
  4      1.3340000E+01          2.13507442331E-01      
  5      5.2520000E+00          3.90298638510E-01      
  6      2.1200000E+00          3.93173596091E-01      
  7      2.5280000E-01          4.06184894329E-03      
P   7
  1      4.8150000E+02         -4.25569009947E-04      
  2      1.1390000E+02         -3.40291062261E-03      
  3      3.6230000E+01         -1.52876322745E-02      
  4      1.3340000E+01         -4.88388953554E-02      
  5      5.2520000E+00         -8.46377238216E-02      
  6      2.1200000E+00         -1.12384993388E-01      
  7      2.5280000E-01          5.35328212769E-01      
P   1
  1      8.5610000E-01          1.0000000        
P   1
  1      7.8890000E-02          1.0000000        
D   1
  1      4.8100000E-01          1.0000000        
D   1
  1      1.5900000E-01          1.0000000        
F   1
  1      3.3600000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: P
data:
PHOSPHORUS
S   13
  1      3.1240000E+05          1.03095463899E-04      
  2      4.6800000E+04          5.22141284513E-04      
  3      1.0650000E+04          2.54460704366E-03      
  4      3.0180000E+03          1.03474812455E-02      
  5      9.8680000E+02          3.53772703393E-02      
  6      3.5740000E+02          1.02086652606E-01      
  7      1.3960000E+02          2.35991379774E-01      
  8      5.7630000E+01          3.81883528573E-01      
  9      2.4600000E+01          3.15601213161E-01      
 10      1.0120000E+01          6.98419346507E-02      
 11      4.2830000E+00         -1.80322857160E-03      
 12      1.8050000E+00          2.12760481137E-03      
 13      2.7820000E-01          4.25479894625E-04      
S   13
  1      3.1240000E+05         -2.76283962391E-05      
  2      4.6800000E+04         -1.39808250375E-04      
  3      1.0650000E+04         -6.90525530432E-04      
  4      3.0180000E+03         -2.83771351651E-03      
  5      9.8680000E+02         -9.89829956223E-03      
  6      3.5740000E+02         -2.96822537102E-02      
  7      1.3960000E+02         -7.55230520798E-02      
  8      5.7630000E+01         -1.50611047557E-01      
  9      2.4600000E+01         -1.87963529766E-01      
 10      1.0120000E+01          4.05426412571E-02      
 11      4.2830000E+00          5.31064103185E-01      
 12      1.8050000E+00          5.15020067129E-01      
 13      2.7820000E-01         -8.95574515660E-03      
S   13
  1      3.1240000E+05          7.64615349168E-06      
  2      4.6800000E+04          3.84901982560E-05      
  3      1.0650000E+04          1.90738697087E-04      
  4      3.0180000E+03          7.81761713089E-04      
  5      9.8680000E+02          2.73777987586E-03      
  6      3.5740000E+02          8.21400312157E-03      
  7      1.3960000E+02          2.11505075644E-02      
  8      5.7630000E+01          4.27932072061E-02      
  9      2.4600000E+01          5.60713330706E-02      
 10      1.0120000E+01         -1.41913153171E-02      
 11      4.2830000E+00         -1.98730003538E-01      
 12      1.8050000E+00         -3.53670785570E-01      
 13      2.7820000E-01          7.02971943652E-01      
S   1
  1      6.1580000E-01          1.0000000        
S   1
  1      1.0550000E-01          1.0000000        
P   7
  1      5.0490000E+02          2.48251698473E-03      
  2      1.1940000E+02          1.88910932261E-02      
  3      3.7960000E+01          8.56286576075E-02      
  4      1.3950000E+01          2.45118237026E-01      
  5      5.4570000E+00          4.22539318828E-01      
  6      2.1770000E+00          3.67646999616E-01      
  7      2.8770000E-01         -3.34309400929E-03      
P   7
  1      5.0490000E+02         -5.86176776625E-04      
  2      1.1940000E+02         -4.52064461581E-03      
  3      3.7960000E+01         -2.06731916321E-02      
  4      1.3950000E+01         -6.15704500696E-02      
  5      5.4570000E+00         -1.08153479838E-01      
  6      2.1770000E+00         -1.04763550748E-01      
  7      2.8770000E-01          5.46208778032E-01      
P   1
  1      8.0100000E-01          1.0000000        
P   1
  1      9.7140000E-02          1.0000000        
D   1
  1      6.5200000E-01          1.0000000        
D   1
  1      2.1600000E-01          1.0000000        
F   1
  1      4.5200000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: S
data:
SULFUR
S   13
  1      3.7410000E+05          1.08380460351E-04      
  2      5.6050000E+04          5.15322168684E-04      
  3      1.2760000E+04          2.43582711437E-03      
  4      3.6150000E+03          9.81406751735E-03      
  5      1.1830000E+03          3.34655979095E-02      
  6      4.2880000E+02          9.67773405876E-02      
  7      1.6780000E+02          2.25539258042E-01      
  8      6.9470000E+01          3.73972348569E-01      
  9      2.9840000E+01          3.26322399411E-01      
 10      1.2720000E+01          8.34737195858E-02      
 11      5.2440000E+00          4.21948044989E-04      
 12      2.2190000E+00          1.61518234779E-03      
 13      3.4900000E-01          2.94909663246E-04      
S   13
  1      3.7410000E+05         -2.97210549231E-05      
  2      5.6050000E+04         -1.40344183375E-04      
  3      1.2760000E+04         -6.73316870012E-04      
  4      3.6150000E+03         -2.73531854292E-03      
  5      1.1830000E+03         -9.53428557764E-03      
  6      4.2880000E+02         -2.85397792590E-02      
  7      1.6780000E+02         -7.31728915997E-02      
  8      6.9470000E+01         -1.47240277997E-01      
  9      2.9840000E+01         -1.93720806246E-01      
 10      1.2720000E+01          1.29473375553E-02      
 11      5.2440000E+00          5.19686786461E-01      
 12      2.2190000E+00          5.37423346187E-01      
 13      3.4900000E-01         -8.84705725454E-03      
S   13
  1      3.7410000E+05          8.66916339374E-06      
  2      5.6050000E+04          4.07377660148E-05      
  3      1.2760000E+04          1.96069557196E-04      
  4      3.6150000E+03          7.94605589013E-04      
  5      1.1830000E+03          2.77973702013E-03      
  6      4.2880000E+02          8.32999815806E-03      
  7      1.6780000E+02          2.15963854017E-02      
  8      6.9470000E+01          4.41443183286E-02      
  9      2.9840000E+01          6.08458701945E-02      
 10      1.2720000E+01         -5.22916608454E-03      
 11      5.2440000E+00         -2.06906282181E-01      
 12      2.2190000E+00         -3.80145954418E-01      
 13      3.4900000E-01          7.14471405230E-01      
S   1
  1      7.7670000E-01          1.0000000        
S   1
  1      1.3220000E-01          1.0000000        
P   7
  1      5.7440000E+02          2.59503882684E-03      
  2      1.3580000E+02          1.96994237338E-02      
  3      4.3190000E+01          8.93397345868E-02      
  4      1.5870000E+01          2.55271820890E-01      
  5      6.2080000E+00          4.33721808094E-01      
  6      2.4830000E+00          3.54051074042E-01      
  7      3.2290000E-01         -4.78806206195E-03      
P   7
  1      5.7440000E+02         -6.64105241737E-04      
  2      1.3580000E+02         -5.04566987592E-03      
  3      4.3190000E+01         -2.34758052201E-02      
  4      1.5870000E+01         -6.86318217625E-02      
  5      6.2080000E+00         -1.23804472724E-01      
  6      2.4830000E+00         -9.61120156868E-02      
  7      3.2290000E-01          5.62511887710E-01      
P   1
  1      8.6880000E-01          1.0000000        
P   1
  1      1.0980000E-01          1.0000000        
D   1
  1      8.1900000E-01          1.0000000        
D   1
  1      2.6900000E-01          1.0000000        
F   1
  1      5.5700000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   13
  1      4.5610000E+05          1.11154377342E-04      
  2      6.8330000E+04          4.97070668865E-04      
  3      1.5550000E+04          2.26712421288E-03      
  4      4.4050000E+03          9.05084842586E-03      
  5      1.4390000E+03          3.09272860783E-02      
  6      5.2040000E+02          9.01641803196E-02      
  7      2.0310000E+02          2.13723134022E-01      
  8      8.3960000E+01          3.65161367160E-01      
  9      3.6200000E+01          3.37821378912E-01      
 10      1.5830000E+01          1.00522972348E-01      
 11      6.3340000E+00          3.04584665062E-03      
 12      2.6940000E+00          1.02785114234E-03      
 13      4.3130000E-01          1.51038084468E-04      
S   13
  1      4.5610000E+05         -3.11068266027E-05      
  2      6.8330000E+04         -1.37408417362E-04      
  3      1.5550000E+04         -6.36873592876E-04      
  4      4.4050000E+03         -2.55708952085E-03      
  5      1.4390000E+03         -8.94621487416E-03      
  6      5.2040000E+02         -2.68809141149E-02      
  7      2.0310000E+02         -6.99809251188E-02      
  8      8.3960000E+01         -1.42841536681E-01      
  9      3.6200000E+01         -1.98070054357E-01      
 10      1.5830000E+01         -1.42183217409E-02      
 11      6.3340000E+00          5.03864364012E-01      
 12      2.6940000E+00          5.58310957864E-01      
 13      4.3130000E-01         -8.03698679996E-03      
S   13
  1      4.5610000E+05          9.45229580839E-06      
  2      6.8330000E+04          4.15215775724E-05      
  3      1.5550000E+04          1.93227150071E-04      
  4      4.4050000E+03          7.73478925921E-04      
  5      1.4390000E+03          2.71680858973E-03      
  6      5.2040000E+02          8.16972373026E-03      
  7      2.0310000E+02          2.15069404154E-02      
  8      8.3960000E+01          4.45735805776E-02      
  9      3.6200000E+01          6.47309327978E-02      
 10      1.5830000E+01          4.16168965184E-03      
 11      6.3340000E+00         -2.09369205264E-01      
 12      2.6940000E+00         -4.03289794172E-01      
 13      4.3130000E-01          7.25633938367E-01      
S   1
  1      9.7680000E-01          1.0000000        
S   1
  1      1.6250000E-01          1.0000000        
P   7
  1      6.6330000E+02          2.60223167219E-03      
  2      1.5680000E+02          1.97017429213E-02      
  3      4.9980000E+01          8.94545717159E-02      
  4      1.8420000E+01          2.56791343278E-01      
  5      7.2400000E+00          4.36682941051E-01      
  6      2.9220000E+00          3.49291193909E-01      
  7      3.8180000E-01         -4.55257085230E-03      
P   7
  1      6.6330000E+02         -7.05738028998E-04      
  2      1.5680000E+02         -5.32721000605E-03      
  3      4.9980000E+01         -2.49619566517E-02      
  4      1.8420000E+01         -7.30067355693E-02      
  5      7.2400000E+00         -1.33903204707E-01      
  6      2.9220000E+00         -9.40174318536E-02      
  7      3.8180000E-01          5.64051564975E-01      
P   1
  1      1.0220000E+00          1.0000000        
P   1
  1      1.3010000E-01          1.0000000        
D   1
  1      1.0460000E+00          1.0000000        
D   1
  1      3.4400000E-01          1.0000000        
F   1
  1      7.0600000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ar
data:
ARGON
S   13
  1      5.4500000E+05          1.15282207613E-04      
  2      8.1640000E+04          4.88648385379E-04      
  3      1.8580000E+04          2.15143097030E-03      
  4      5.2610000E+03          8.48620765918E-03      
  5      1.7170000E+03          2.89931991632E-02      
  6      6.1990000E+02          8.49454372213E-02      
  7      2.4160000E+02          2.03827300378E-01      
  8      9.9790000E+01          3.56810782398E-01      
  9      4.3150000E+01          3.46234121434E-01      
 10      1.9140000E+01          1.16242002255E-01      
 11      7.4880000E+00          5.46819668235E-03      
 12      3.2050000E+00          4.59791705671E-04      
 13      5.2040000E-01          2.60315471350E-05      
S   13
  1      5.4500000E+05         -3.28273850562E-05      
  2      8.1640000E+04         -1.36994698969E-04      
  3      1.8580000E+04         -6.13007972037E-04      
  4      5.2610000E+03         -2.42709017222E-03      
  5      1.7170000E+03         -8.49930011328E-03      
  6      6.1990000E+02         -2.55854645719E-02      
  7      2.4160000E+02         -6.73046952763E-02      
  8      9.9790000E+01         -1.39093884755E-01      
  9      4.3150000E+01         -2.00559502089E-01      
 10      1.9140000E+01         -3.52828435849E-02      
 11      7.4880000E+00          4.89885272317E-01      
 12      3.2050000E+00          5.73095925058E-01      
 13      5.2040000E-01         -7.00657319212E-03      
S   13
  1      5.4500000E+05          1.03063263184E-05      
  2      8.1640000E+04          4.27486557954E-05      
  3      1.8580000E+04          1.92199997640E-04      
  4      5.2610000E+03          7.58278282091E-04      
  5      1.7170000E+03          2.66662847104E-03      
  6      6.1990000E+02          8.03184707061E-03      
  7      2.4160000E+02          2.13637269748E-02      
  8      9.9790000E+01          4.48166125016E-02      
  9      4.3150000E+01          6.76415014997E-02      
 10      1.9140000E+01          1.19588971833E-02      
 11      7.4880000E+00         -2.11022995666E-01      
 12      3.2050000E+00         -4.22124344573E-01      
 13      5.2040000E-01          7.33769436382E-01      
S   1
  1      1.1960000E+00          1.0000000        
S   1
  1      1.9540000E-01          1.0000000        
P   7
  1      7.6180000E+02          2.59347377368E-03      
  2      1.8020000E+02          1.95749724848E-02      
  3      5.7500000E+01          8.91738353265E-02      
  4      2.1240000E+01          2.57298517554E-01      
  5      8.3880000E+00          4.38446911965E-01      
  6      3.4160000E+00          3.46323110746E-01      
  7      4.5230000E-01         -5.20319813157E-03      
P   7
  1      7.6180000E+02         -7.30212432009E-04      
  2      1.8020000E+02         -5.48465145099E-03      
  3      5.7500000E+01         -2.58748484279E-02      
  4      2.1240000E+01         -7.59659581853E-02      
  5      8.3880000E+00         -1.40997493446E-01      
  6      3.4160000E+00         -9.23157774022E-02      
  7      4.5230000E-01          5.61757023405E-01      
P   1
  1      1.2060000E+00          1.0000000        
P   1
  1      1.5450000E-01          1.0000000        
D   1
  1      1.2540000E+00          1.0000000        
D   1
  1      4.1000000E-01          1.0000000        
F   1
  1      8.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ga
data:
GALLIUM
S   18
  1      6.5581573E+06          1.05221087094E-04      
  2      9.8202534E+05          3.07235371677E-04      
  3      2.2346769E+05          8.63067753860E-04      
  4      6.3288291E+04          2.40974626578E-03      
  5      2.0642940E+04          6.92730861756E-03      
  6      7.4505224E+03          1.95559123517E-02      
  7      2.9050744E+03          5.17945867610E-02      
  8      1.2042100E+03          1.22770734282E-01      
  9      5.2430454E+02          2.42868712471E-01      
 10      2.3746563E+02          3.50031549156E-01      
 11      1.1057866E+02          2.81600595162E-01      
 12      5.1374624E+01          7.66786213539E-02      
 13      2.4440846E+01          6.12710870806E-04      
 14      1.1768591E+01          1.48739225810E-03      
 15      5.3421190E+00         -7.09793257000E-04      
 16      2.4950360E+00          2.87911076518E-04      
 17      1.0987730E+00         -1.22257731839E-04      
 18      2.6018000E-01          4.72499655033E-05      
S   18
  1      6.5581573E+06         -3.36445093058E-05      
  2      9.8202534E+05         -9.81679860928E-05      
  3      2.2346769E+05         -2.74762627649E-04      
  4      6.3288291E+04         -7.66662808021E-04      
  5      2.0642940E+04         -2.21353502010E-03      
  6      7.4505224E+03         -6.32277902992E-03      
  7      2.9050744E+03         -1.71828175287E-02      
  8      1.2042100E+03         -4.28389031935E-02      
  9      5.2430454E+02         -9.45349010219E-02      
 10      2.3746563E+02         -1.68865506301E-01      
 11      1.1057866E+02         -1.92625962699E-01      
 12      5.1374624E+01          3.24420514144E-02      
 13      2.4440846E+01          5.07419794254E-01      
 14      1.1768591E+01          5.11731442188E-01      
 15      5.3421190E+00          1.01146824158E-01      
 16      2.4950360E+00         -5.34252327248E-04      
 17      1.0987730E+00          1.95181765838E-03      
 18      2.6018000E-01         -4.15140210944E-04      
S   18
  1      6.5581573E+06          1.28807311018E-05      
  2      9.8202534E+05          3.76340982693E-05      
  3      2.2346769E+05          1.05339104418E-04      
  4      6.3288291E+04          2.94224636349E-04      
  5      2.0642940E+04          8.48779089835E-04      
  6      7.4505224E+03          2.42980411096E-03      
  7      2.9050744E+03          6.61110597117E-03      
  8      1.2042100E+03          1.66186675042E-02      
  9      5.2430454E+02          3.70962721843E-02      
 10      2.3746563E+02          6.84786170746E-02      
 11      1.1057866E+02          8.18113051894E-02      
 12      5.1374624E+01         -1.54655386664E-02      
 13      2.4440846E+01         -3.14988643044E-01      
 14      1.1768591E+01         -4.70644375451E-01      
 15      5.3421190E+00          1.20976935772E-01      
 16      2.4950360E+00          7.33552463473E-01      
 17      1.0987730E+00          4.04643645113E-01      
 18      2.6018000E-01          1.69300617288E-02      
S   18
  1      6.5581573E+06         -3.01896856505E-06      
  2      9.8202534E+05         -8.83684083484E-06      
  3      2.2346769E+05         -2.46634441625E-05      
  4      6.3288291E+04         -6.90966685626E-05      
  5      2.0642940E+04         -1.98714958608E-04      
  6      7.4505224E+03         -5.70792289780E-04      
  7      2.9050744E+03         -1.54844789659E-03      
  8      1.2042100E+03         -3.91091414214E-03      
  9      5.2430454E+02         -8.70540957584E-03      
 10      2.3746563E+02         -1.62376950179E-02      
 11      1.1057866E+02         -1.93069915396E-02      
 12      5.1374624E+01          3.35179033029E-03      
 13      2.4440846E+01          7.98576126543E-02      
 14      1.1768591E+01          1.22561859230E-01      
 15      5.3421190E+00         -3.72761043962E-02      
 16      2.4950360E+00         -2.62339123421E-01      
 17      1.0987730E+00         -2.68286528987E-01      
 18      2.6018000E-01          3.44872844452E-01      
S   1
  1      1.2707900E-01          1.0000000        
S   1
  1      5.4408000E-02          1.0000000        
P   11
  1      8.0501674E+03          5.79795607834E-04      
  2      1.9075361E+03          3.39082637173E-03      
  3      6.1862746E+02          1.67833935894E-02      
  4      2.3532417E+02          6.30518881162E-02      
  5      9.8899646E+01          1.77291424895E-01      
  6      4.4248215E+01          3.42656736750E-01      
  7      2.0617429E+01          3.86388387597E-01      
  8      9.7805160E+00          1.80087944044E-01      
  9      4.4412380E+00          2.12490237353E-02      
 10      1.9640450E+00          1.11134773269E-03      
 11      8.3357800E-01          2.75487153090E-04      
P   11
  1      8.0501674E+03         -2.20951587226E-04      
  2      1.9075361E+03         -1.29353426118E-03      
  3      6.1862746E+02         -6.48627686008E-03      
  4      2.3532417E+02         -2.47903463050E-02      
  5      9.8899646E+01         -7.27837457037E-02      
  6      4.4248215E+01         -1.47655563157E-01      
  7      2.0617429E+01         -1.74727815781E-01      
  8      9.7805160E+00          4.27625304898E-02      
  9      4.4412380E+00          4.27426112594E-01      
 10      1.9640450E+00          4.91497369884E-01      
 11      8.3357800E-01          1.75135783091E-01      
P   11
  1      8.0501674E+03          3.66219229858E-05      
  2      1.9075361E+03          2.07781193928E-04      
  3      6.1862746E+02          1.07749837439E-03      
  4      2.3532417E+02          3.99044576249E-03      
  5      9.8899646E+01          1.22192956703E-02      
  6      4.4248215E+01          2.36746232934E-02      
  7      2.0617429E+01          3.10298433384E-02      
  8      9.7805160E+00         -1.49445673793E-02      
  9      4.4412380E+00         -7.37882163606E-02      
 10      1.9640450E+00         -1.26380449546E-01      
 11      8.3357800E-01          2.02586427451E-02      
P   1
  1      1.9344500E-01          1.0000000        
P   1
  1      5.6117000E-02          1.0000000        
D   7
  1      2.4414741E+02          2.12445402372E-03      
  2      7.3067595E+01          1.66598242869E-02      
  3      2.7592081E+01          7.02251156730E-02      
  4      1.1546518E+01          1.90037178737E-01      
  5      5.0486280E+00          3.24020100309E-01      
  6      2.1784650E+00          3.66721592389E-01      
  7      9.0025300E-01          2.77290356979E-01      
D   1
  1      3.3732700E-01          1.0000000        
D   1
  1      1.1690000E-01          1.0000000        
F   1
  1      2.8810000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   18
  1      7.4479668E+06          1.07209922013E-04      
  2      1.1153182E+06          3.10198668927E-04      
  3      2.5384265E+05          8.58011744862E-04      
  4      7.1915285E+04          2.34388433369E-03      
  5      2.3470181E+04          6.60566063770E-03      
  6      8.4774918E+03          1.84093966148E-02      
  7      3.3083908E+03          4.85069522867E-02      
  8      1.3726054E+03          1.15245642941E-01      
  9      5.9822007E+02          2.30769052262E-01      
 10      2.7138602E+02          3.42934179883E-01      
 11      1.2697795E+02          2.94153130765E-01      
 12      6.0222065E+01          9.34242728543E-02      
 13      2.8018582E+01          3.73861023092E-03      
 14      1.3517522E+01          9.29503178345E-04      
 15      6.3094060E+00         -4.56718038382E-04      
 16      2.9045340E+00          1.61018245301E-04      
 17      1.2875560E+00         -8.45396993259E-05      
 18      1.6773200E-01         -2.43523184794E-05      
S   18
  1      7.4479668E+06         -3.44789037100E-05      
  2      1.1153182E+06         -9.96140116594E-05      
  3      2.5384265E+05         -2.75099394239E-04      
  4      7.1915285E+04         -7.49558408801E-04      
  5      2.3470181E+04         -2.12405509778E-03      
  6      8.4774918E+03         -5.97469430093E-03      
  7      3.3083908E+03         -1.61575052820E-02      
  8      1.3726054E+03         -4.01863314420E-02      
  9      5.9822007E+02         -8.93732254727E-02      
 10      2.7138602E+02         -1.61880100926E-01      
 11      1.2697795E+02         -1.96846401054E-01      
 12      6.0222065E+01         -3.62140586627E-03      
 13      2.8018582E+01          4.73246687536E-01      
 14      1.3517522E+01          5.39463604664E-01      
 15      6.3094060E+00          1.27651989698E-01      
 16      2.9045340E+00          1.88177838800E-03      
 17      1.2875560E+00          1.88841481204E-03      
 18      1.6773200E-01          2.86636320463E-04      
S   18
  1      7.4479668E+06          1.33451702512E-05      
  2      1.1153182E+06          3.85534411517E-05      
  3      2.5384265E+05          1.06675245722E-04      
  4      7.1915285E+04          2.90387978558E-04      
  5      2.3470181E+04          8.23856488300E-04      
  6      8.4774918E+03          2.31806342979E-03      
  7      3.3083908E+03          6.28660803700E-03      
  8      1.3726054E+03          1.57304081239E-02      
  9      5.9822007E+02          3.54333046000E-02      
 10      2.7138602E+02          6.60318217492E-02      
 11      1.2697795E+02          8.43643939043E-02      
 12      6.0222065E+01          9.22879003550E-04      
 13      2.8018582E+01         -2.87663442141E-01      
 14      1.3517522E+01         -4.90678640992E-01      
 15      6.3094060E+00          4.48879345165E-02      
 16      2.9045340E+00          7.31417304800E-01      
 17      1.2875560E+00          4.53634588735E-01      
 18      1.6773200E-01         -7.97677569289E-03      
S   18
  1      7.4479668E+06         -3.44701259488E-06      
  2      1.1153182E+06         -9.96927844061E-06      
  3      2.5384265E+05         -2.75314665128E-05      
  4      7.1915285E+04         -7.50974260071E-05      
  5      2.3470181E+04         -2.12575491595E-04      
  6      8.4774918E+03         -5.99768393655E-04      
  7      3.3083908E+03         -1.62278347349E-03      
  8      1.3726054E+03         -4.07679035743E-03      
  9      5.9822007E+02         -9.16431805152E-03      
 10      2.7138602E+02         -1.72379919131E-02      
 11      1.2697795E+02         -2.19675409422E-02      
 12      6.0222065E+01         -5.70478727497E-04      
 13      2.8018582E+01          8.01281805915E-02      
 14      1.3517522E+01          1.41378718586E-01      
 15      6.3094060E+00         -1.67752122899E-02      
 16      2.9045340E+00         -2.86294634561E-01      
 17      1.2875560E+00         -3.23014671404E-01      
 18      1.6773200E-01          6.00936732302E-01      
S   1
  1      3.3655200E-01          1.0000000        
S   1
  1      7.1069000E-02          1.0000000        
P   11
  1      6.9795982E+03          7.98488651803E-04      
  2      1.6541648E+03          4.78668386464E-03      
  3      5.3602865E+02          2.34758789160E-02      
  4      2.0353713E+02          8.56685132970E-02      
  5      8.5237530E+01          2.26526576905E-01      
  6      3.7841962E+01          3.90785141339E-01      
  7      1.7406512E+01          3.51173965424E-01      
  8      7.8814920E+00          1.04096245575E-01      
  9      3.5332130E+00          3.58555721929E-03      
 10      1.5214730E+00          1.84646510387E-03      
 11      1.9909300E-01          1.81174606998E-04      
P   11
  1      6.9795982E+03         -3.08208568435E-04      
  2      1.6541648E+03         -1.86217346176E-03      
  3      5.3602865E+02         -9.21303736200E-03      
  4      2.0353713E+02         -3.46018411529E-02      
  5      8.5237530E+01         -9.52973665682E-02      
  6      3.7841962E+01         -1.76026095226E-01      
  7      1.7406512E+01         -1.42217898043E-01      
  8      7.8814920E+00          1.93561741285E-01      
  9      3.5332130E+00          5.27512529386E-01      
 10      1.5214730E+00          3.90618653993E-01      
 11      1.9909300E-01         -2.99752489445E-03      
P   11
  1      6.9795982E+03          6.05363511591E-05      
  2      1.6541648E+03          3.63898149011E-04      
  3      5.3602865E+02          1.81295878009E-03      
  4      2.0353713E+02          6.78764199050E-03      
  5      8.5237530E+01          1.89169696163E-02      
  6      3.7841962E+01          3.48685296605E-02      
  7      1.7406512E+01          2.83608909742E-02      
  8      7.8814920E+00         -4.85907324117E-02      
  9      3.5332130E+00         -1.24466284115E-01      
 10      1.5214730E+00         -1.17985753444E-01      
 11      1.9909300E-01          5.53514439864E-01      
P   1
  1      5.6270400E-01          1.0000000        
P   1
  1      6.7031000E-02          1.0000000        
D   7
  1      2.8223911E+02          1.93047142773E-03      
  2      8.4549957E+01          1.53443931810E-02      
  3      3.2073656E+01          6.59936089945E-02      
  4      1.3497495E+01          1.82971684930E-01      
  5      5.9585500E+00          3.21434929725E-01      
  6      2.6107880E+00          3.71764933673E-01      
  7      1.1039870E+00          2.78008987760E-01      
D   1
  1      4.2404900E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      3.4580000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: As
data:
ARSENIC
S   18
  1      8.4823396E+06          1.08762460516E-04      
  2      1.2701509E+06          3.11999050293E-04      
  3      2.8905696E+05          8.50741502306E-04      
  4      8.1879849E+04          2.27688158967E-03      
  5      2.6716564E+04          6.29631621874E-03      
  6      9.6475842E+03          1.73327900743E-02      
  7      3.7641195E+03          4.54592552301E-02      
  8      1.5615656E+03          1.08251536263E-01      
  9      6.8081467E+02          2.19180409222E-01      
 10      3.0924119E+02          3.34877688563E-01      
 11      1.4525736E+02          3.04850616853E-01      
 12      6.9739048E+01          1.11275573479E-01      
 13      3.1770325E+01          7.30823194714E-03      
 14      1.5391757E+01          2.57119026516E-04      
 15      7.3415260E+00         -1.45082714738E-04      
 16      3.3237160E+00          1.45123523159E-05      
 17      1.4858670E+00         -3.31655361867E-05      
 18      2.1150000E-01         -8.29800762501E-06      
S   18
  1      8.4823396E+06         -3.51683154044E-05      
  2      1.2701509E+06         -1.00691819742E-04      
  3      2.8905696E+05         -2.74582105077E-04      
  4      8.1879849E+04         -7.31925977855E-04      
  5      2.6716564E+04         -2.03680610969E-03      
  6      9.6475842E+03         -5.64698607737E-03      
  7      3.7641195E+03         -1.52007533252E-02      
  8      1.5615656E+03         -3.77355072371E-02      
  9      6.8081467E+02         -8.44892160938E-02      
 10      3.0924119E+02         -1.55006283409E-01      
 11      1.4525736E+02         -1.98893222718E-01      
 12      6.9739048E+01         -3.36435117838E-02      
 13      3.1770325E+01          4.38364339106E-01      
 14      1.5391757E+01          5.58652699539E-01      
 15      7.3415260E+00          1.55368019538E-01      
 16      3.3237160E+00          4.98003288616E-03      
 17      1.4858670E+00          1.67107841818E-03      
 18      2.1150000E-01          2.27549669977E-04      
S   18
  1      8.4823396E+06          1.37602644949E-05      
  2      1.2701509E+06          3.93533346193E-05      
  3      2.8905696E+05          1.07674240907E-04      
  4      8.1879849E+04          2.86310504666E-04      
  5      2.6716564E+04          7.99054142281E-04      
  6      9.6475842E+03          2.21228164485E-03      
  7      3.7641195E+03          5.98070777843E-03      
  8      1.5615656E+03          1.49066603557E-02      
  9      6.8081467E+02          3.38435378700E-02      
 10      3.0924119E+02          6.36280692295E-02      
 11      1.4525736E+02          8.59740540938E-02      
 12      6.9739048E+01          1.45385078797E-02      
 13      3.1770325E+01         -2.62526985100E-01      
 14      1.5391757E+01         -5.02071006711E-01      
 15      7.3415260E+00         -1.93106822688E-02      
 16      3.3237160E+00          7.23075899411E-01      
 17      1.4858670E+00          4.93652325643E-01      
 18      2.1150000E-01         -8.77868702127E-03      
S   18
  1      8.4823396E+06         -3.81984003149E-06      
  2      1.2701509E+06         -1.09308954975E-05      
  3      2.8905696E+05         -2.98715289327E-05      
  4      8.1879849E+04         -7.95312808038E-05      
  5      2.6716564E+04         -2.21598895414E-04      
  6      9.6475842E+03         -6.14918914408E-04      
  7      3.7641195E+03         -1.65930047679E-03      
  8      1.5615656E+03         -4.14965540409E-03      
  9      6.8081467E+02         -9.40779507422E-03      
 10      3.0924119E+02         -1.78374167666E-02      
 11      1.4525736E+02         -2.40790476270E-02      
 12      6.9739048E+01         -4.42184755631E-03      
 13      3.1770325E+01          7.84239241138E-02      
 14      1.5391757E+01          1.55838515028E-01      
 15      7.3415260E+00          4.00992890298E-03      
 16      3.3237160E+00         -3.03687852544E-01      
 17      1.4858670E+00         -3.70764868628E-01      
 18      2.1150000E-01          6.30864041660E-01      
S   1
  1      4.2108600E-01          1.0000000        
S   1
  1      8.8974000E-02          1.0000000        
P   11
  1      7.4238614E+03          8.27884614894E-04      
  2      1.7595166E+03          4.87543827086E-03      
  3      5.7022916E+02          2.37885758604E-02      
  4      2.1657997E+02          8.65471844242E-02      
  5      9.0734252E+01          2.28357404454E-01      
  6      4.0308791E+01          3.92259931088E-01      
  7      1.8555502E+01          3.48950803021E-01      
  8      8.3965430E+00          1.01751203983E-01      
  9      3.7673670E+00          3.26040507660E-03      
 10      1.6297010E+00          1.77253589315E-03      
 11      2.2250300E-01          2.14106818030E-04      
P   11
  1      7.4238614E+03         -3.24339238794E-04      
  2      1.7595166E+03         -1.92582686367E-03      
  3      5.7022916E+02         -9.47883792298E-03      
  4      2.1657997E+02         -3.55137425725E-02      
  5      9.0734252E+01         -9.76268313544E-02      
  6      4.0308791E+01         -1.79782453805E-01      
  7      1.8555502E+01         -1.41512088081E-01      
  8      8.3965430E+00          2.04474535555E-01      
  9      3.7673670E+00          5.37741696926E-01      
 10      1.6297010E+00          3.78592015823E-01      
 11      2.2250300E-01         -4.67323253520E-03      
P   11
  1      7.4238614E+03          7.15949048415E-05      
  2      1.7595166E+03          4.26122815740E-04      
  3      5.7022916E+02          2.09598120221E-03      
  4      2.1657997E+02          7.89396392176E-03      
  5      9.0734252E+01          2.17574642939E-02      
  6      4.0308791E+01          4.05747206786E-02      
  7      1.8555502E+01          3.08544285750E-02      
  8      8.3965430E+00         -5.62486093945E-02      
  9      3.7673670E+00         -1.51123151595E-01      
 10      1.6297010E+00         -1.18979011608E-01      
 11      2.2250300E-01          5.48714398408E-01      
P   1
  1      5.6826300E-01          1.0000000        
P   1
  1      8.0405000E-02          1.0000000        
D   7
  1      3.2101961E+02          1.79292883108E-03      
  2      9.6249305E+01          1.43842695419E-02      
  3      3.6644963E+01          6.28700688872E-02      
  4      1.5493965E+01          1.77648155443E-01      
  5      6.8911380E+00          3.19638753474E-01      
  6      3.0548310E+00          3.76112332482E-01      
  7      1.3142410E+00          2.77845031789E-01      
D   1
  1      5.1343000E-01          1.0000000        
D   1
  1      1.8770000E-01          1.0000000        
F   1
  1      4.1580000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Se
data:
SELENIUM
S   18
  1      9.5636000E+06          1.10900739705E-04      
  2      1.4321000E+06          3.15644590114E-04      
  3      3.2591000E+05          8.49880456050E-04      
  4      9.2312000E+04          2.23266232029E-03      
  5      3.0116000E+04          6.06357201547E-03      
  6      1.0872000E+04          1.64873809859E-02      
  7      4.2401000E+03          4.30219981800E-02      
  8      1.7584000E+03          1.02576756898E-01      
  9      7.6659000E+02          2.09521539945E-01      
 10      3.4843000E+02          3.27354753413E-01      
 11      1.6403000E+02          3.12936736699E-01      
 12      7.9142000E+01          1.27195041395E-01      
 13      3.5524000E+01          1.06817867700E-02      
 14      1.7305000E+01         -3.78316770958E-04      
 15      8.3784000E+00          1.49801858425E-04      
 16      3.7405000E+00         -1.18850016201E-04      
 17      1.6890000E+00          1.98488510163E-05      
 18      2.5520000E-01          8.12497895436E-06      
S   18
  1      9.5636000E+06         -3.60423062226E-05      
  2      1.4321000E+06         -1.02377865766E-04      
  3      3.2591000E+05         -2.75981934343E-04      
  4      9.2312000E+04         -7.21560481384E-04      
  5      3.0116000E+04         -1.97282335661E-03      
  6      1.0872000E+04         -5.39398723312E-03      
  7      4.2401000E+03         -1.44419375388E-02      
  8      1.7584000E+03         -3.57835691405E-02      
  9      7.6659000E+02         -8.05123723685E-02      
 10      3.4843000E+02         -1.49307431911E-01      
 11      1.6403000E+02         -1.99516243685E-01      
 12      7.9142000E+01         -5.61334854424E-02      
 13      3.5524000E+01          4.07550106919E-01      
 14      1.7305000E+01          5.69968765167E-01      
 15      8.3784000E+00          1.80839365901E-01      
 16      3.7405000E+00          8.17583157733E-03      
 17      1.6890000E+00          1.36243514086E-03      
 18      2.5520000E-01          1.48342932734E-04      
S   18
  1      9.5636000E+06          1.42510066580E-05      
  2      1.4321000E+06          4.04072552285E-05      
  3      3.2591000E+05          1.09392592301E-04      
  4      9.2312000E+04          2.85015070122E-04      
  5      3.0116000E+04          7.82492164962E-04      
  6      1.0872000E+04          2.13380330037E-03      
  7      4.2401000E+03          5.74398339447E-03      
  8      1.7584000E+03          1.42667856787E-02      
  9      7.6659000E+02          3.25790444112E-02      
 10      3.4843000E+02          6.17213243270E-02      
 11      1.6403000E+02          8.69716098484E-02      
 12      7.9142000E+01          2.48229899273E-02      
 13      3.5524000E+01         -2.42127739856E-01      
 14      1.7305000E+01         -5.07426910394E-01      
 15      8.3784000E+00         -6.98647804313E-02      
 16      3.7405000E+00          7.12846714810E-01      
 17      1.6890000E+00          5.23867886633E-01      
 18      2.5520000E-01         -9.06657630596E-03      
S   18
  1      9.5636000E+06         -4.18599864387E-06      
  2      1.4321000E+06         -1.18739434860E-05      
  3      3.2591000E+05         -3.21144879304E-05      
  4      9.2312000E+04         -8.37593612492E-05      
  5      3.0116000E+04         -2.29616206817E-04      
  6      1.0872000E+04         -6.27536466273E-04      
  7      4.2401000E+03         -1.68621305033E-03      
  8      1.7584000E+03         -4.20167204282E-03      
  9      7.6659000E+02         -9.58166857805E-03      
 10      3.4843000E+02         -1.83054804809E-02      
 11      1.6403000E+02         -2.57754097720E-02      
 12      7.9142000E+01         -7.76005672304E-03      
 13      3.5524000E+01          7.65405567881E-02      
 14      1.7305000E+01          1.66758533465E-01      
 15      8.3784000E+00          2.30023170101E-02      
 16      3.7405000E+00         -3.18360275227E-01      
 17      1.6890000E+00         -4.10900307551E-01      
 18      2.5520000E-01          6.57984173390E-01      
S   1
  1      5.0927000E-01          1.0000000        
S   1
  1      1.0651000E-01          1.0000000        
P   11
  1      8.0043000E+03          8.40567459178E-04      
  2      1.8969000E+03          4.84891399464E-03      
  3      6.1471000E+02          2.35516581659E-02      
  4      2.3350000E+02          8.56411801303E-02      
  5      9.7856000E+01          2.26599632038E-01      
  6      4.3514000E+01          3.91013804292E-01      
  7      2.0063000E+01          3.50344973682E-01      
  8      9.1127000E+00          1.03926043881E-01      
  9      4.1063000E+00          3.56904280779E-03      
 10      1.7949000E+00          1.72214527039E-03      
 11      2.4615000E-01          2.05676360156E-04      
P   11
  1      8.0043000E+03         -3.34136096109E-04      
  2      1.8969000E+03         -1.94311053468E-03      
  3      6.1471000E+02         -9.52348585971E-03      
  4      2.3350000E+02         -3.56517201635E-02      
  5      9.7856000E+01         -9.83381849304E-02      
  6      4.3514000E+01         -1.81866814355E-01      
  7      2.0063000E+01         -1.44728224766E-01      
  8      9.1127000E+00          2.03395778910E-01      
  9      4.1063000E+00          5.42054675610E-01      
 10      1.7949000E+00          3.76042657056E-01      
 11      2.4615000E-01         -4.46117320936E-03      
P   11
  1      8.0043000E+03          8.04243065217E-05      
  2      1.8969000E+03          4.70354055847E-04      
  3      6.1471000E+02          2.29603581053E-03      
  4      2.3350000E+02          8.67321857051E-03      
  5      9.7856000E+01          2.38910254830E-02      
  6      4.3514000E+01          4.50480150954E-02      
  7      2.0063000E+01          3.40308868285E-02      
  8      9.1127000E+00         -6.07681225522E-02      
  9      4.1063000E+00         -1.71718860245E-01      
 10      1.7949000E+00         -1.23712693021E-01      
 11      2.4615000E-01          5.67379485520E-01      
P   1
  1      6.2432000E-01          1.0000000        
P   1
  1      8.8917000E-02          1.0000000        
D   7
  1      3.6185000E+02          1.67997409344E-03      
  2      1.0855000E+02          1.35833145608E-02      
  3      4.1433000E+01          6.02771048162E-02      
  4      1.7579000E+01          1.73270535632E-01      
  5      7.8627000E+00          3.18248890159E-01      
  6      3.5180000E+00          3.79889151516E-01      
  7      1.5348000E+00          2.77315647117E-01      
D   1
  1      6.0813000E-01          1.0000000        
D   1
  1      2.2200000E-01          1.0000000        
F   1
  1      4.6200000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Br
data:
BROMINE
S   18
  1      1.0639000E+07          1.13938401770E-04      
  2      1.5934000E+06          3.21977190249E-04      
  3      3.6261000E+05          8.57570232360E-04      
  4      1.0270000E+05          2.21625439189E-03      
  5      3.3501000E+04          5.91910945881E-03      
  6      1.2093000E+04          1.58934252987E-02      
  7      4.7159000E+03          4.12175561536E-02      
  8      1.9556000E+03          9.82336707835E-02      
  9      8.5261000E+02          2.01891358480E-01      
 10      3.8767000E+02          3.20912961659E-01      
 11      1.8268000E+02          3.18790424628E-01      
 12      8.8245000E+01          1.40261555679E-01      
 13      3.9263000E+01          1.36424939901E-02      
 14      1.9234000E+01         -9.14786849927E-04      
 15      9.4057000E+00          3.98053420779E-04      
 16      4.1601000E+00         -2.30078636654E-04      
 17      1.8995000E+00          6.87447793706E-05      
 18      3.0114000E-01          2.23330948942E-05      
S   18
  1      1.0639000E+07         -3.72083872424E-05      
  2      1.5934000E+06         -1.04951134326E-04      
  3      3.6261000E+05         -2.80060870228E-04      
  4      1.0270000E+05         -7.20161209096E-04      
  5      3.3501000E+04         -1.93652423920E-03      
  6      1.2093000E+04         -5.22306266290E-03      
  7      4.7159000E+03         -1.38923805620E-02      
  8      1.9556000E+03         -3.43301376179E-02      
  9      8.5261000E+02         -7.74637777711E-02      
 10      3.8767000E+02         -1.44900619801E-01      
 11      1.8268000E+02         -1.99483015121E-01      
 12      8.8245000E+01         -7.26394212619E-02      
 13      3.9263000E+01          3.81736462743E-01      
 14      1.9234000E+01          5.76303167440E-01      
 15      9.4057000E+00          2.02954642964E-01      
 16      4.1601000E+00          1.11793823111E-02      
 17      1.8995000E+00          1.02874667441E-03      
 18      3.0114000E-01          6.94175749865E-05      
S   18
  1      1.0639000E+07          1.48606514840E-05      
  2      1.5934000E+06          4.18263588284E-05      
  3      3.6261000E+05          1.12146400189E-04      
  4      1.0270000E+05          2.87216319269E-04      
  5      3.3501000E+04          7.76146701153E-04      
  6      1.2093000E+04          2.08613115992E-03      
  7      4.7159000E+03          5.58290257686E-03      
  8      1.9556000E+03          1.38142987507E-02      
  9      8.5261000E+02          3.16549358478E-02      
 10      3.8767000E+02          6.03586144409E-02      
 11      1.8268000E+02          8.76808652940E-02      
 12      8.8245000E+01          3.25275703652E-02      
 13      3.9263000E+01         -2.26160628153E-01      
 14      1.9234000E+01         -5.09741095367E-01      
 15      9.4057000E+00         -1.09972454042E-01      
 16      4.1601000E+00          7.02290396903E-01      
 17      1.8995000E+00          5.47268208768E-01      
 18      3.0114000E-01         -8.97301816429E-03      
S   18
  1      1.0639000E+07         -4.56925712389E-06      
  2      1.5934000E+06         -1.28640696547E-05      
  3      3.6261000E+05         -3.44653212695E-05      
  4      1.0270000E+05         -8.83425254739E-05      
  5      3.3501000E+04         -2.38411452656E-04      
  6      1.2093000E+04         -6.42169965231E-04      
  7      4.7159000E+03         -1.71558887291E-03      
  8      1.9556000E+03         -4.25816876586E-03      
  9      8.5261000E+02         -9.74464731205E-03      
 10      3.8767000E+02         -1.87370584823E-02      
 11      1.8268000E+02         -2.72025535090E-02      
 12      8.8245000E+01         -1.05429636184E-02      
 13      3.9263000E+01          7.48905741520E-02      
 14      1.9234000E+01          1.75457636735E-01      
 15      9.4057000E+00          3.97318508006E-02      
 16      4.1601000E+00         -3.30510522728E-01      
 17      1.8995000E+00         -4.45923512058E-01      
 18      3.0114000E-01          6.80835293151E-01      
S   1
  1      6.0472000E-01          1.0000000        
S   1
  1      1.2515000E-01          1.0000000        
P   11
  1      8.6765000E+03          8.45787764372E-04      
  2      2.0559000E+03          4.77033148712E-03      
  3      6.6623000E+02          2.30621748758E-02      
  4      2.5310000E+02          8.38829388116E-02      
  5      1.0612000E+02          2.23034609593E-01      
  6      4.7242000E+01          3.88325746925E-01      
  7      2.1825000E+01          3.53486883584E-01      
  8      9.9684000E+00          1.08435759822E-01      
  9      4.5171000E+00          4.21642447551E-03      
 10      1.9982000E+00          1.69415457833E-03      
 11      2.8145000E-01          1.97955283116E-04      
P   11
  1      8.6765000E+03         -3.40944731677E-04      
  2      2.0559000E+03         -1.93779441367E-03      
  3      6.6623000E+02         -9.45742561595E-03      
  4      2.5310000E+02         -3.53885711385E-02      
  5      1.0612000E+02         -9.81520205979E-02      
  6      4.7242000E+01         -1.82988066654E-01      
  7      2.1825000E+01         -1.49894978629E-01      
  8      9.9684000E+00          1.96116105875E-01      
  9      4.5171000E+00          5.43446308048E-01      
 10      1.9982000E+00          3.79118289195E-01      
 11      2.8145000E-01         -4.03698098628E-03      
P   11
  1      8.6765000E+03          8.78468234804E-05      
  2      2.0559000E+03          5.02669340218E-04      
  3      6.6623000E+02          2.44079062220E-03      
  4      2.5310000E+02          9.22832937467E-03      
  5      1.0612000E+02          2.55310904651E-02      
  6      4.7242000E+01          4.86486860968E-02      
  7      2.1825000E+01          3.76986839680E-02      
  8      9.9684000E+00         -6.31361233296E-02      
  9      4.5171000E+00         -1.87930184640E-01      
 10      1.9982000E+00         -1.31851238800E-01      
 11      2.8145000E-01          5.72349544224E-01      
P   1
  1      7.0988000E-01          1.0000000        
P   1
  1      1.0204000E-01          1.0000000        
D   7
  1      4.0383000E+02          1.59384455676E-03      
  2      1.2117000E+02          1.29607933459E-02      
  3      4.6345000E+01          5.82501571286E-02      
  4      1.9721000E+01          1.69846940036E-01      
  5      8.8624000E+00          3.17283537141E-01      
  6      3.9962000E+00          3.83118919051E-01      
  7      1.7636000E+00          2.76413984707E-01      
D   1
  1      7.0619000E-01          1.0000000        
D   1
  1      2.6390000E-01          1.0000000        
F   1
  1      5.5150000E-01          1.0000000


name: cc-pVTZ(pt/sf/fw)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   18
  1      1.1718113E+07          1.17683266977E-04      
  2      1.7546044E+06          3.30450726194E-04      
  3      3.9928132E+05          8.71629692698E-04      
  4      1.1308457E+05          2.21962396144E-03      
  5      3.6885925E+04          5.83734061515E-03      
  6      1.3312209E+04          1.54860021051E-02      
  7      5.1899883E+03          3.99085371432E-02      
  8      2.1516597E+03          9.49786345080E-02      
  9      9.3803251E+02          1.95998397168E-01      
 10      4.2655732E+02          3.15604148513E-01      
 11      2.0106660E+02          3.22937935148E-01      
 12      9.7097605E+01          1.50685683083E-01      
 13      4.2998724E+01          1.61730895930E-02      
 14      2.1177075E+01         -1.34404456748E-03      
 15      1.0426752E+01          5.95437394083E-04      
 16      4.5850080E+00         -3.19825939655E-04      
 17      2.1176030E+00          1.11807858020E-04      
 18      3.4922500E-01          3.37345127124E-05      
S   18
  1      1.1718113E+07         -3.86101659637E-05      
  2      1.7546044E+06         -1.08239671369E-04      
  3      3.9928132E+05         -2.86183226594E-04      
  4      1.1308457E+05         -7.25164287975E-04      
  5      3.6885925E+04         -1.92010931793E-03      
  6      1.3312209E+04         -5.11301387278E-03      
  7      5.1899883E+03         -1.35078155407E-02      
  8      2.1516597E+03         -3.32778840704E-02      
  9      9.3803251E+02         -7.51933912337E-02      
 10      4.2655732E+02         -1.41575076288E-01      
 11      2.0106660E+02         -1.99201323371E-01      
 12      9.7097605E+01         -8.47966354546E-02      
 13      4.2998724E+01          3.60499554627E-01      
 14      2.1177075E+01          5.79581200894E-01      
 15      1.0426752E+01          2.21790209823E-01      
 16      4.5850080E+00          1.38911785246E-02      
 17      2.1176030E+00          7.05013636887E-04      
 18      3.4922500E-01          7.22815210654E-07      
S   18
  1      1.1718113E+07          1.55689712116E-05      
  2      1.7546044E+06          4.35448976433E-05      
  3      3.9928132E+05          1.15709728981E-04      
  4      1.1308457E+05          2.91936607563E-04      
  5      3.6885925E+04          7.77212141945E-04      
  6      1.3312209E+04          2.06136358188E-03      
  7      5.1899883E+03          5.48214815151E-03      
  8      2.1516597E+03          1.35128726508E-02      
  9      9.3803251E+02          3.10196414010E-02      
 10      4.2655732E+02          5.94419946119E-02      
 11      2.0106660E+02          8.82811186371E-02      
 12      9.7097605E+01          3.83511414125E-02      
 13      4.2998724E+01         -2.13721717725E-01      
 14      2.1177075E+01         -5.10759317637E-01      
 15      1.0426752E+01         -1.42211012733E-01      
 16      4.5850080E+00          6.92707957800E-01      
 17      2.1176030E+00          5.65393453655E-01      
 18      3.4922500E-01         -8.60763583524E-03      
S   18
  1      1.1718113E+07         -4.97250239824E-06      
  2      1.7546044E+06         -1.39096581318E-05      
  3      3.9928132E+05         -3.69406000291E-05      
  4      1.1308457E+05         -9.32609352921E-05      
  5      3.6885925E+04         -2.47997625282E-04      
  6      1.3312209E+04         -6.59069743081E-04      
  7      5.1899883E+03         -1.74993417459E-03      
  8      2.1516597E+03         -4.32612179601E-03      
  9      9.3803251E+02         -9.91858321301E-03      
 10      4.2655732E+02         -1.91666700879E-02      
 11      2.0106660E+02         -2.84520854594E-02      
 12      9.7097605E+01         -1.28549461630E-02      
 13      4.2998724E+01          7.35943881913E-02      
 14      2.1177075E+01          1.82742739956E-01      
 15      1.0426752E+01          5.44423375837E-02      
 16      4.5850080E+00         -3.41218552268E-01      
 17      2.1176030E+00         -4.76707600833E-01      
 18      3.4922500E-01          7.00131205587E-01      
S   1
  1      7.0705700E-01          1.0000000        
S   1
  1      1.4482100E-01          1.0000000        
P   11
  1      9.3663090E+03          8.54252638887E-04      
  2      2.2195543E+03          4.71017286633E-03      
  3      7.1945288E+02          2.26419497885E-02      
  4      2.7346446E+02          8.22763123325E-02      
  5      1.1475225E+02          2.19606371727E-01      
  6      5.1155569E+01          3.85517179857E-01      
  7      2.3682676E+01          3.56366560806E-01      
  8      1.0875484E+01          1.12934211481E-01      
  9      4.9551310E+00          4.90212715694E-03      
 10      2.2172670E+00          1.66167201829E-03      
 11      3.2215400E-01          2.04626261493E-04      
P   11
  1      9.3663090E+03         -3.49095550493E-04      
  2      2.2195543E+03         -1.93900983181E-03      
  3      7.1945288E+02         -9.41366612767E-03      
  4      2.7346446E+02         -3.51680302374E-02      
  5      1.1475225E+02         -9.79716805234E-02      
  6      5.1155569E+01         -1.84000928527E-01      
  7      2.3682676E+01         -1.54917200834E-01      
  8      1.0875484E+01          1.88872715787E-01      
  9      4.9551310E+00          5.44610714438E-01      
 10      2.2172670E+00          3.82524562829E-01      
 11      3.2215400E-01         -4.43861283478E-03      
P   11
  1      9.3663090E+03          9.44528045328E-05      
  2      2.2195543E+03          5.28502441954E-04      
  3      7.1945288E+02          2.55125566848E-03      
  4      2.7346446E+02          9.63852992556E-03      
  5      1.1475225E+02          2.67696486035E-02      
  6      5.1155569E+01          5.14672853568E-02      
  7      2.3682676E+01          4.09509528658E-02      
  8      1.0875484E+01         -6.44663756740E-02      
  9      4.9551310E+00         -2.01211502743E-01      
 10      2.2172670E+00         -1.38993108506E-01      
 11      3.2215400E-01          5.72480756031E-01      
P   1
  1      8.0641000E-01          1.0000000        
P   1
  1      1.1761900E-01          1.0000000        
D   7
  1      4.4616133E+02          1.53182732929E-03      
  2      1.3396477E+02          1.24911626177E-02      
  3      5.1345907E+01          5.66776407402E-02      
  4      2.1916906E+01          1.67078208504E-01      
  5      9.8937250E+00          3.16446414659E-01      
  6      4.4925270E+00          3.85818199730E-01      
  7      2.0022930E+00          2.75376462807E-01      
D   1
  1      8.0840900E-01          1.0000000        
D   1
  1      3.0060000E-01          1.0000000        
F   1
  1      6.6220000E-01          1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: H
data:
HYDROGEN
S   3
  1     33.8700000              0.0060680        
  2      5.0950000              0.0453080        
  3      1.1590000              0.2028220        
S   1
  1      0.3258000              1.0000000        
S   1
  1      0.1027000              1.0000000        
P   1
  1      1.4070000              1.0000000        
P   1
  1      0.3880000              1.0000000        
D   1
  1      1.0570000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: He
data:
HELIUM
S   4
  1    234.0000000              0.0025870        
  2     35.1600000              0.0195330        
  3      7.9890000              0.0909980        
  4      2.2120000              0.2720500        
S   1
  1      0.6669000              1.0000000        
S   1
  1      0.2089000              1.0000000        
P   1
  1      3.0440000              1.0000000        
P   1
  1      0.7580000              1.0000000        
D   1
  1      1.9650000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Li
data:
LITHIUM
S   9
  1   5988.0000000              0.0001330        
  2    898.9000000              0.0010250        
  3    205.9000000              0.0052720        
  4     59.2400000              0.0209290        
  5     19.8700000              0.0663400        
  6      7.4060000              0.1657750        
  7      2.9300000              0.3150380        
  8      1.1890000              0.3935230        
  9      0.4798000              0.1908700        
S   9
  1   5988.0000000             -0.0000210        
  2    898.9000000             -0.0001610        
  3    205.9000000             -0.0008200        
  4     59.2400000             -0.0033260        
  5     19.8700000             -0.0105190        
  6      7.4060000             -0.0280970        
  7      2.9300000             -0.0559360        
  8      1.1890000             -0.0992370        
  9      0.4798000             -0.1121890        
S   1
  1      0.0750900              1.0000000        
S   1
  1      0.0283200              1.0000000        
P   3
  1      3.2660000              0.0086300        
  2      0.6511000              0.0475380        
  3      0.1696000              0.2097720        
P   1
  1      0.0557800              1.0000000        
P   1
  1      0.0205000              1.0000000        
D   1
  1      0.1874000              1.0000000        
D   1
  1      0.0801000              1.0000000        
F   1
  1      0.1829000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Be
data:
BERYLLIUM
S   9
  1   6863.0000000              0.0002360        
  2   1030.0000000              0.0018260        
  3    234.7000000              0.0094520        
  4     66.5600000              0.0379570        
  5     21.6900000              0.1199650        
  6      7.7340000              0.2821620        
  7      2.9160000              0.4274040        
  8      1.1300000              0.2662780        
  9      0.1101000             -0.0072750        
S   9
  1   6863.0000000             -0.0000430        
  2   1030.0000000             -0.0003330        
  3    234.7000000             -0.0017360        
  4     66.5600000             -0.0070120        
  5     21.6900000             -0.0231260        
  6      7.7340000             -0.0581380        
  7      2.9160000             -0.1145560        
  8      1.1300000             -0.1359080        
  9      0.1101000              0.5774410        
S   1
  1      0.2577000              1.0000000        
S   1
  1      0.0440900              1.0000000        
P   3
  1      7.4360000              0.0107360        
  2      1.5770000              0.0628540        
  3      0.4352000              0.2481800        
P   1
  1      0.1438000              1.0000000        
P   1
  1      0.0499400              1.0000000        
D   1
  1      0.3480000              1.0000000        
D   1
  1      0.1803000              1.0000000        
F   1
  1      0.3250000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: B
data:
BORON
S   8
  1   5473.0000000              0.0005550        
  2    820.9000000              0.0042910        
  3    186.8000000              0.0219490        
  4     52.8300000              0.0844410        
  5     17.0800000              0.2385570        
  6      5.9990000              0.4350720        
  7      2.2080000              0.3419550        
  8      0.2415000             -0.0095450        
S   8
  1   5473.0000000             -0.0001120        
  2    820.9000000             -0.0008680        
  3    186.8000000             -0.0044840        
  4     52.8300000             -0.0176830        
  5     17.0800000             -0.0536390        
  6      5.9990000             -0.1190050        
  7      2.2080000             -0.1658240        
  8      0.2415000              0.5959810        
S   1
  1      0.5879000              1.0000000        
S   1
  1      0.0861000              1.0000000        
P   3
  1     12.0500000              0.0131180        
  2      2.6130000              0.0798960        
  3      0.7475000              0.2772750        
P   1
  1      0.2385000              1.0000000        
P   1
  1      0.0769800              1.0000000        
D   1
  1      0.6610000              1.0000000        
D   1
  1      0.1990000              1.0000000        
F   1
  1      0.4900000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: C
data:
CARBON
S   8
  1   8236.0000000              0.0005310        
  2   1235.0000000              0.0041080        
  3    280.8000000              0.0210870        
  4     79.2700000              0.0818530        
  5     25.5900000              0.2348170        
  6      8.9970000              0.4344010        
  7      3.3190000              0.3461290        
  8      0.3643000             -0.0089830        
S   8
  1   8236.0000000             -0.0001130        
  2   1235.0000000             -0.0008780        
  3    280.8000000             -0.0045400        
  4     79.2700000             -0.0181330        
  5     25.5900000             -0.0557600        
  6      8.9970000             -0.1268950        
  7      3.3190000             -0.1703520        
  8      0.3643000              0.5986840        
S   1
  1      0.9059000              1.0000000        
S   1
  1      0.1285000              1.0000000        
P   3
  1     18.7100000              0.0140310        
  2      4.1330000              0.0868660        
  3      1.2000000              0.2902160        
P   1
  1      0.3827000              1.0000000        
P   1
  1      0.1209000              1.0000000        
D   1
  1      1.0970000              1.0000000        
D   1
  1      0.3180000              1.0000000        
F   1
  1      0.7610000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: N
data:
NITROGEN
S   8
  1  11420.0000000              0.0005230        
  2   1712.0000000              0.0040450        
  3    389.3000000              0.0207750        
  4    110.0000000              0.0807270        
  5     35.5700000              0.2330740        
  6     12.5400000              0.4335010        
  7      4.6440000              0.3474720        
  8      0.5118000             -0.0085080        
S   8
  1  11420.0000000             -0.0001150        
  2   1712.0000000             -0.0008950        
  3    389.3000000             -0.0046240        
  4    110.0000000             -0.0185280        
  5     35.5700000             -0.0573390        
  6     12.5400000             -0.1320760        
  7      4.6440000             -0.1725100        
  8      0.5118000              0.5999440        
S   1
  1      1.2930000              1.0000000        
S   1
  1      0.1787000              1.0000000        
P   3
  1     26.6300000              0.0146700        
  2      5.9480000              0.0917640        
  3      1.7420000              0.2986830        
P   1
  1      0.5550000              1.0000000        
P   1
  1      0.1725000              1.0000000        
D   1
  1      1.6540000              1.0000000        
D   1
  1      0.4690000              1.0000000        
F   1
  1      1.0930000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: O
data:
OXYGEN
S   8
  1  15330.0000000              0.0005080        
  2   2299.0000000              0.0039290        
  3    522.4000000              0.0202430        
  4    147.3000000              0.0791810        
  5     47.5500000              0.2306870        
  6     16.7600000              0.4331180        
  7      6.2070000              0.3502600        
  8      0.6882000             -0.0081540        
S   8
  1  15330.0000000             -0.0001150        
  2   2299.0000000             -0.0008950        
  3    522.4000000             -0.0046360        
  4    147.3000000             -0.0187240        
  5     47.5500000             -0.0584630        
  6     16.7600000             -0.1364630        
  7      6.2070000             -0.1757400        
  8      0.6882000              0.6034180        
S   1
  1      1.7520000              1.0000000        
S   1
  1      0.2384000              1.0000000        
P   3
  1     34.4600000              0.0159280        
  2      7.7490000              0.0997400        
  3      2.2800000              0.3104920        
P   1
  1      0.7156000              1.0000000        
P   1
  1      0.2140000              1.0000000        
D   1
  1      2.3140000              1.0000000        
D   1
  1      0.6450000              1.0000000        
F   1
  1      1.4280000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: F
data:
FLUORINE
S   8
  1  19500.0000000              0.0005070        
  2   2923.0000000              0.0039230        
  3    664.5000000              0.0202000        
  4    187.5000000              0.0790100        
  5     60.6200000              0.2304390        
  6     21.4200000              0.4328720        
  7      7.9500000              0.3499640        
  8      0.8815000             -0.0078920        
S   8
  1  19500.0000000             -0.0001170        
  2   2923.0000000             -0.0009120        
  3    664.5000000             -0.0047170        
  4    187.5000000             -0.0190860        
  5     60.6200000             -0.0596550        
  6     21.4200000             -0.1400100        
  7      7.9500000             -0.1767820        
  8      0.8815000              0.6050430        
S   1
  1      2.2570000              1.0000000        
S   1
  1      0.3041000              1.0000000        
P   3
  1     43.8800000              0.0166650        
  2      9.9260000              0.1044720        
  3      2.9300000              0.3172600        
P   1
  1      0.9132000              1.0000000        
P   1
  1      0.2672000              1.0000000        
D   1
  1      3.1070000              1.0000000        
D   1
  1      0.8550000              1.0000000        
F   1
  1      1.9170000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ne
data:
NEON
S   8
  1  24350.0000000              0.0005020        
  2   3650.0000000              0.0038810        
  3    829.6000000              0.0199970        
  4    234.0000000              0.0784180        
  5     75.6100000              0.2296760        
  6     26.7300000              0.4327220        
  7      9.9270000              0.3506420        
  8      1.1020000             -0.0076450        
S   8
  1  24350.0000000             -0.0001180        
  2   3650.0000000             -0.0009150        
  3    829.6000000             -0.0047370        
  4    234.0000000             -0.0192330        
  5     75.6100000             -0.0603690        
  6     26.7300000             -0.1425080        
  7      9.9270000             -0.1777100        
  8      1.1020000              0.6058360        
S   1
  1      2.8360000              1.0000000        
S   1
  1      0.3782000              1.0000000        
P   3
  1     54.7000000              0.0171510        
  2     12.4300000              0.1076560        
  3      3.6790000              0.3216810        
P   1
  1      1.1430000              1.0000000        
P   1
  1      0.3300000              1.0000000        
D   1
  1      4.0140000              1.0000000        
D   1
  1      1.0960000              1.0000000        
F   1
  1      2.5440000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Na
data:
SODIUM
S   14
  1 423000.0000000              0.180618E-04     
  2  63340.0000000              0.140430E-03     
  3  14410.0000000              0.738438E-03     
  4   4077.0000000              0.311182E-02     
  5   1328.0000000              0.112081E-01     
  6    478.6000000              0.352828E-01     
  7    186.2000000              0.959897E-01     
  8     76.9200000              0.213735E+00     
  9     33.3200000              0.348688E+00     
 10     15.0000000              0.324566E+00     
 11      6.8690000              0.112633E+00     
 12      2.6830000              0.706797E-02     
 13      1.1090000              0.598010E-03     
 14      0.0601500             -0.530870E-05     
S   14
  1 423000.0000000             -0.440653E-05     
  2  63340.0000000             -0.343443E-04     
  3  14410.0000000             -0.180114E-03     
  4   4077.0000000             -0.763900E-03     
  5   1328.0000000             -0.275248E-02     
  6    478.6000000             -0.886016E-02     
  7    186.2000000             -0.247939E-01     
  8     76.9200000             -0.605995E-01     
  9     33.3200000             -0.116446E+00     
 10     15.0000000             -0.162437E+00     
 11      6.8690000             -0.438891E-01     
 12      2.6830000              0.337917E+00     
 13      1.1090000              0.561347E+00     
 14      0.0601500              0.406754E-02     
S   14
  1 423000.0000000              0.663019E-06     
  2  63340.0000000              0.515769E-05     
  3  14410.0000000              0.271250E-04     
  4   4077.0000000              0.114635E-03     
  5   1328.0000000              0.415118E-03     
  6    478.6000000              0.132978E-02     
  7    186.2000000              0.375595E-02     
  8     76.9200000              0.914025E-02     
  9     33.3200000              0.179859E-01     
 10     15.0000000              0.251477E-01     
 11      6.8690000              0.763522E-02     
 12      2.6830000             -0.614589E-01     
 13      1.1090000             -0.115721E+00     
 14      0.0601500              0.626406E+00     
S   1
  1      0.4540000              1.0000000        
S   1
  1      0.0238200              1.0000000        
P   8
  1    243.3000000              0.224392E-02     
  2     57.3900000              0.173997E-01     
  3     18.1000000              0.774125E-01     
  4      6.5750000              0.219102E+00     
  5      2.5210000              0.378522E+00     
  6      0.9607000              0.394902E+00     
  7      0.3512000              0.160424E+00     
  8      0.0982700              0.233311E-02     
P   8
  1    243.3000000             -0.222401E-03     
  2     57.3900000             -0.174277E-02     
  3     18.1000000             -0.775456E-02     
  4      6.5750000             -0.225187E-01     
  5      2.5210000             -0.384330E-01     
  6      0.9607000             -0.450177E-01     
  7      0.3512000             -0.192132E-01     
  8      0.0982700              0.182697E+00     
P   1
  1      0.0373400              1.0000000        
P   1
  1      0.0150000              1.0000000        
D   1
  1      0.1367000              1.0000000        
D   1
  1      0.0636000              1.0000000        
F   1
  1      0.1397000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Mg
data:
MAGNESIUM
S   13
  1 164900.0000000              0.729929E-04     
  2  24710.0000000              0.566652E-03     
  3   5628.0000000              0.296269E-02     
  4   1596.0000000              0.122962E-01     
  5    521.0000000              0.427324E-01     
  6    188.0000000              0.123013E+00     
  7     73.0100000              0.274832E+00     
  8     29.9000000              0.401818E+00     
  9     12.5400000              0.264697E+00     
 10      4.3060000              0.332612E-01     
 11      1.8260000             -0.441335E-02     
 12      0.7417000              0.206024E-02     
 13      0.0761200              0.708195E-03     
S   13
  1 164900.0000000             -0.184248E-04     
  2  24710.0000000             -0.143500E-03     
  3   5628.0000000             -0.748710E-03     
  4   1596.0000000             -0.314407E-02     
  5    521.0000000             -0.110481E-01     
  6    188.0000000             -0.336058E-01     
  7     73.0100000             -0.825946E-01     
  8     29.9000000             -0.159314E+00     
  9     12.5400000             -0.152888E+00     
 10      4.3060000              0.190849E+00     
 11      1.8260000              0.579964E+00     
 12      0.7417000              0.372029E+00     
 13      0.0761200             -0.119344E-01     
S   13
  1 164900.0000000              0.355176E-05     
  2  24710.0000000              0.276420E-04     
  3   5628.0000000              0.144404E-03     
  4   1596.0000000              0.605744E-03     
  5    521.0000000              0.213527E-02     
  6    188.0000000              0.649934E-02     
  7     73.0100000              0.161446E-01     
  8     29.9000000              0.315766E-01     
  9     12.5400000              0.316374E-01     
 10      4.3060000             -0.439140E-01     
 11      1.8260000             -0.151093E+00     
 12      0.7417000             -0.217668E+00     
 13      0.0761200              0.547245E+00     
S   1
  1      0.1457000              1.0000000        
S   1
  1      0.0331000              1.0000000        
P   8
  1    316.9000000              0.207532E-02     
  2     74.8600000              0.162869E-01     
  3     23.7200000              0.738697E-01     
  4      8.6690000              0.214297E+00     
  5      3.3630000              0.382154E+00     
  6      1.3100000              0.398178E+00     
  7      0.4911000              0.152878E+00     
  8      0.2364000             -0.437540E-02     
P   8
  1    316.9000000             -0.329727E-03     
  2     74.8600000             -0.258754E-02     
  3     23.7200000             -0.119120E-01     
  4      8.6690000             -0.350227E-01     
  5      3.3630000             -0.639968E-01     
  6      1.3100000             -0.704436E-01     
  7      0.4911000             -0.375836E-01     
  8      0.2364000              0.177043E+00     
P   1
  1      0.0873300              1.0000000        
P   1
  1      0.0323700              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.2940000              1.0000000        
F   1
  1      0.2520000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Al
data:
ALUMINUM
S   13
  1 205500.0000000              0.678836E-04     
  2  30780.0000000              0.527149E-03     
  3   7006.0000000              0.276203E-02     
  4   1985.0000000              0.114728E-01     
  5    649.1000000              0.398188E-01     
  6    235.0000000              0.115040E+00     
  7     91.6200000              0.260887E+00     
  8     37.6700000              0.396386E+00     
  9     15.9100000              0.284597E+00     
 10      5.8500000              0.444583E-01     
 11      2.5420000             -0.489838E-02     
 12      1.0570000              0.261253E-02     
 13      0.1455000              0.722068E-03     
S   13
  1 205500.0000000             -0.176377E-04     
  2  30780.0000000             -0.137195E-03     
  3   7006.0000000             -0.718910E-03     
  4   1985.0000000             -0.301146E-02     
  5    649.1000000             -0.106014E-01     
  6    235.0000000             -0.321345E-01     
  7     91.6200000             -0.803156E-01     
  8     37.6700000             -0.156794E+00     
  9     15.9100000             -0.168376E+00     
 10      5.8500000              0.126879E+00     
 11      2.5420000              0.561494E+00     
 12      1.0570000              0.436613E+00     
 13      0.1455000             -0.114563E-01     
S   13
  1 205500.0000000              0.407315E-05     
  2  30780.0000000              0.316566E-04     
  3   7006.0000000              0.166116E-03     
  4   1985.0000000              0.694992E-03     
  5    649.1000000              0.245511E-02     
  6    235.0000000              0.744598E-02     
  7     91.6200000              0.188253E-01     
  8     37.6700000              0.372772E-01     
  9     15.9100000              0.419496E-01     
 10      5.8500000             -0.354375E-01     
 11      2.5420000             -0.175132E+00     
 12      1.0570000             -0.276203E+00     
 13      0.1455000              0.652809E+00     
S   1
  1      0.2931000              1.0000000        
S   1
  1      0.0565000              1.0000000        
P   7
  1    444.4000000              0.162786E-02     
  2    105.1000000              0.130687E-01     
  3     33.4700000              0.612341E-01     
  4     12.3300000              0.187870E+00     
  5      4.8690000              0.360452E+00     
  6      1.9610000              0.408454E+00     
  7      0.1888000              0.976514E-02     
P   7
  1    444.4000000             -0.286341E-03     
  2    105.1000000             -0.242308E-02     
  3     33.4700000             -0.108658E-01     
  4     12.3300000             -0.364307E-01     
  5      4.8690000             -0.641074E-01     
  6      1.9610000             -0.972239E-01     
  7      0.1888000              0.503448E+00     
P   1
  1      0.7834000              1.0000000        
P   1
  1      0.0555700              1.0000000        
D   1
  1      0.1090000              1.0000000        
D   1
  1      0.3330000              1.0000000        
F   1
  1      0.2440000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Si
data:
SILICON
S   13
  1 254900.0000000              0.625101E-04     
  2  38190.0000000              0.485553E-03     
  3   8690.0000000              0.254516E-02     
  4   2462.0000000              0.105866E-01     
  5    804.8000000              0.368787E-01     
  6    291.3000000              0.107479E+00     
  7    113.6000000              0.247936E+00     
  8     46.7500000              0.390927E+00     
  9     19.8200000              0.302026E+00     
 10      7.7080000              0.559236E-01     
 11      3.3400000             -0.402406E-02     
 12      1.4020000              0.258030E-02     
 13      0.2070000              0.607930E-03     
S   13
  1 254900.0000000             -0.166370E-04     
  2  38190.0000000             -0.129310E-03     
  3   8690.0000000             -0.678828E-03     
  4   2462.0000000             -0.284117E-02     
  5    804.8000000             -0.100551E-01     
  6    291.3000000             -0.305774E-01     
  7    113.6000000             -0.777256E-01     
  8     46.7500000             -0.154236E+00     
  9     19.8200000             -0.180368E+00     
 10      7.7080000              0.798218E-01     
 11      3.3400000              0.547441E+00     
 12      1.4020000              0.480119E+00     
 13      0.2070000             -0.106996E-01     
S   13
  1 254900.0000000              0.426257E-05     
  2  38190.0000000              0.331062E-04     
  3   8690.0000000              0.174015E-03     
  4   2462.0000000              0.727574E-03     
  5    804.8000000              0.258333E-02     
  6    291.3000000              0.786354E-02     
  7    113.6000000              0.202155E-01     
  8     46.7500000              0.407320E-01     
  9     19.8200000              0.499358E-01     
 10      7.7080000             -0.249396E-01     
 11      3.3400000             -0.190350E+00     
 12      1.4020000             -0.318350E+00     
 13      0.2070000              0.681180E+00     
S   1
  1      0.4387000              1.0000000        
S   1
  1      0.0794400              1.0000000        
P   7
  1    481.5000000              0.192045E-02     
  2    113.9000000              0.153552E-01     
  3     36.2300000              0.713991E-01     
  4     13.3400000              0.213052E+00     
  5      5.2520000              0.390354E+00     
  6      2.1200000              0.393721E+00     
  7      0.2528000              0.395630E-02     
P   7
  1    481.5000000             -0.405220E-03     
  2    113.9000000             -0.335896E-02     
  3     36.2300000             -0.152860E-01     
  4     13.3400000             -0.489218E-01     
  5      5.2520000             -0.855008E-01     
  6      2.1200000             -0.112137E+00     
  7      0.2528000              0.551919E+00     
P   1
  1      0.8561000              1.0000000        
P   1
  1      0.0788900              1.0000000        
D   1
  1      0.1590000              1.0000000        
D   1
  1      0.4810000              1.0000000        
F   1
  1      0.3360000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: P
data:
PHOSPHORUS
S   13
  1 312400.0000000              0.576960E-04     
  2  46800.0000000              0.448296E-03     
  3  10650.0000000              0.234939E-02     
  4   3018.0000000              0.978265E-02     
  5    986.8000000              0.341467E-01     
  6    357.4000000              0.100204E+00     
  7    139.6000000              0.234372E+00     
  8     57.6300000              0.382434E+00     
  9     24.6000000              0.318088E+00     
 10     10.1200000              0.707788E-01     
 11      4.2830000             -0.181799E-02     
 12      1.8050000              0.216180E-02     
 13      0.2782000              0.432297E-03     
S   13
  1 312400.0000000             -0.156709E-04     
  2  46800.0000000             -0.121724E-03     
  3  10650.0000000             -0.639672E-03     
  4   3018.0000000             -0.267426E-02     
  5    986.8000000             -0.949831E-02     
  6    357.4000000             -0.289349E-01     
  7    139.6000000             -0.745121E-01     
  8     57.6300000             -0.149938E+00     
  9     24.6000000             -0.189467E+00     
 10     10.1200000              0.363270E-01     
 11      4.2830000              0.528816E+00     
 12      1.8050000              0.519115E+00     
 13      0.2782000             -0.925695E-02     
S   13
  1 312400.0000000              0.430631E-05     
  2  46800.0000000              0.334194E-04     
  3  10650.0000000              0.175885E-03     
  4   3018.0000000              0.734340E-03     
  5    986.8000000              0.261775E-02     
  6    357.4000000              0.797852E-02     
  7    139.6000000              0.207940E-01     
  8     57.6300000              0.424446E-01     
  9     24.6000000              0.563436E-01     
 10     10.1200000             -0.127358E-01     
 11      4.2830000             -0.196495E+00     
 12      1.8050000             -0.353555E+00     
 13      0.2782000              0.700912E+00     
S   1
  1      0.6158000              1.0000000        
S   1
  1      0.1055000              1.0000000        
P   7
  1    504.9000000              0.233728E-02     
  2    119.4000000              0.185410E-01     
  3     37.9600000              0.849693E-01     
  4     13.9500000              0.244615E+00     
  5      5.4570000              0.422766E+00     
  6      2.1770000              0.368439E+00     
  7      0.2877000             -0.379005E-02     
P   7
  1    504.9000000             -0.555236E-03     
  2    119.4000000             -0.445913E-02     
  3     37.9600000             -0.206350E-01     
  4     13.9500000             -0.617694E-01     
  5      5.4570000             -0.108924E+00     
  6      2.1770000             -0.105599E+00     
  7      0.2877000              0.576981E+00     
P   1
  1      0.8010000              1.0000000        
P   1
  1      0.0971400              1.0000000        
D   1
  1      0.2160000              1.0000000        
D   1
  1      0.6520000              1.0000000        
F   1
  1      0.4520000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: S
data:
SULFUR
S   13
  1 374100.0000000              0.542140E-04     
  2  56050.0000000              0.420855E-03     
  3  12760.0000000              0.220698E-02     
  4   3615.0000000              0.919258E-02     
  5   1183.0000000              0.321123E-01     
  6    428.8000000              0.946683E-01     
  7    167.8000000              0.223630E+00     
  8     69.4700000              0.374393E+00     
  9     29.8400000              0.329108E+00     
 10     12.7200000              0.847038E-01     
 11      5.2440000              0.440851E-03     
 12      2.2190000              0.164827E-02     
 13      0.3490000              0.301306E-03     
S   13
  1 374100.0000000             -0.149837E-04     
  2  56050.0000000             -0.116198E-03     
  3  12760.0000000             -0.611583E-03     
  4   3615.0000000             -0.255370E-02     
  5   1183.0000000             -0.908708E-02     
  6    428.8000000             -0.277045E-01     
  7    167.8000000             -0.720020E-01     
  8     69.4700000             -0.146439E+00     
  9     29.8400000             -0.195150E+00     
 10     12.7200000              0.819193E-02     
 11      5.2440000              0.516601E+00     
 12      2.2190000              0.542178E+00     
 13      0.3490000             -0.918072E-02     
S   13
  1 374100.0000000              0.435066E-05     
  2  56050.0000000              0.337140E-04     
  3  12760.0000000              0.177674E-03     
  4   3615.0000000              0.741116E-03     
  5   1183.0000000              0.264591E-02     
  6    428.8000000              0.807487E-02     
  7    167.8000000              0.212276E-01     
  8     69.4700000              0.438323E-01     
  9     29.8400000              0.612716E-01     
 10     12.7200000             -0.361510E-02     
 11      5.2440000             -0.204510E+00     
 12      2.2190000             -0.381871E+00     
 13      0.3490000              0.714147E+00     
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
P   7
  1    574.4000000              0.242264E-02     
  2    135.8000000              0.192796E-01     
  3     43.1900000              0.885401E-01     
  4     15.8700000              0.254654E+00     
  5      6.2080000              0.433984E+00     
  6      2.4830000              0.354953E+00     
  7      0.3229000             -0.502977E-02     
P   7
  1    574.4000000             -0.620102E-03     
  2    135.8000000             -0.493882E-02     
  3     43.1900000             -0.232647E-01     
  4     15.8700000             -0.685195E-01     
  5      6.2080000             -0.123896E+00     
  6      2.4830000             -0.969499E-01     
  7      0.3229000              0.569394E+00     
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
F   1
  1      0.5570000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Cl
data:
CHLORINE
S   13
  1 456100.0000000              0.492970E-04     
  2  68330.0000000              0.383029E-03     
  3  15550.0000000              0.200854E-02     
  4   4405.0000000              0.838558E-02     
  5   1439.0000000              0.294703E-01     
  6    520.4000000              0.878325E-01     
  7    203.1000000              0.211473E+00     
  8     83.9600000              0.365364E+00     
  9     36.2000000              0.340884E+00     
 10     15.8300000              0.102133E+00     
 11      6.3340000              0.311675E-02     
 12      2.6940000              0.105751E-02     
 13      0.4313000              0.156136E-03     
S   13
  1 456100.0000000             -0.138304E-04     
  2  68330.0000000             -0.107279E-03     
  3  15550.0000000             -0.565083E-03     
  4   4405.0000000             -0.236135E-02     
  5   1439.0000000             -0.845886E-02     
  6    520.4000000             -0.259638E-01     
  7    203.1000000             -0.686362E-01     
  8     83.9600000             -0.141874E+00     
  9     36.2000000             -0.199319E+00     
 10     15.8300000             -0.195662E-01     
 11      6.3340000              0.499741E+00     
 12      2.6940000              0.563736E+00     
 13      0.4313000             -0.835091E-02     
S   13
  1 456100.0000000              0.418546E-05     
  2  68330.0000000              0.324395E-04     
  3  15550.0000000              0.171105E-03     
  4   4405.0000000              0.714176E-03     
  5   1439.0000000              0.256705E-02     
  6    520.4000000              0.788552E-02     
  7    203.1000000              0.210867E-01     
  8     83.9600000              0.442264E-01     
  9     36.2000000              0.651670E-01     
 10     15.8300000              0.603012E-02     
 11      6.3340000             -0.206495E+00     
 12      2.6940000             -0.405871E+00     
 13      0.4313000              0.725661E+00     
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
P   7
  1    663.3000000              0.240448E-02     
  2    156.8000000              0.192148E-01     
  3     49.9800000              0.885097E-01     
  4     18.4200000              0.256020E+00     
  5      7.2400000              0.436927E+00     
  6      2.9220000              0.350334E+00     
  7      0.3818000             -0.458423E-02     
P   7
  1    663.3000000             -0.652145E-03     
  2    156.8000000             -0.519445E-02     
  3     49.9800000             -0.246938E-01     
  4     18.4200000             -0.728167E-01     
  5      7.2400000             -0.134030E+00     
  6      2.9220000             -0.947742E-01     
  7      0.3818000              0.564667E+00     
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
F   1
  1      0.7060000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ar
data:
ARGON
S   13
  1 545000.0000000              0.455828E-04     
  2  81640.0000000              0.354108E-03     
  3  18580.0000000              0.185797E-02     
  4   5261.0000000              0.776851E-02     
  5   1717.0000000              0.274232E-01     
  6    619.9000000              0.823836E-01     
  7    241.6000000              0.201230E+00     
  8     99.7900000              0.356781E+00     
  9     43.1500000              0.349563E+00     
 10     19.1400000              0.118266E+00     
 11      7.4880000              0.560190E-02     
 12      3.2050000              0.483473E-03     
 13      0.5204000              0.292025E-04     
S   13
  1 545000.0000000             -0.129551E-04     
  2  81640.0000000             -0.100428E-03     
  3  18580.0000000             -0.529583E-03     
  4   5261.0000000             -0.221396E-02     
  5   1717.0000000             -0.796845E-02     
  6    619.9000000             -0.245803E-01     
  7    241.6000000             -0.657798E-01     
  8     99.7900000             -0.137942E+00     
  9     43.1500000             -0.201630E+00     
 10     19.1400000             -0.412834E-01     
 11      7.4880000              0.484680E+00     
 12      3.2050000              0.579224E+00     
 13      0.5204000             -0.727553E-02     
S   13
  1 545000.0000000              0.404990E-05     
  2  81640.0000000              0.313691E-04     
  3  18580.0000000              0.165646E-03     
  4   5261.0000000              0.691662E-03     
  5   1717.0000000              0.249790E-02     
  6    619.9000000              0.771074E-02     
  7    241.6000000              0.208714E-01     
  8     99.7900000              0.443965E-01     
  9     43.1500000              0.680224E-01     
 10     19.1400000              0.141350E-01     
 11      7.4880000             -0.207489E+00     
 12      3.2050000             -0.425045E+00     
 13      0.5204000              0.733627E+00     
S   1
  1      1.1960000              1.0000000        
S   1
  1      0.1954000              1.0000000        
P   7
  1    761.8000000              0.236976E-02     
  2    180.2000000              0.190199E-01     
  3     57.5000000              0.880807E-01     
  4     21.2400000              0.256377E+00     
  5      8.3880000              0.438711E+00     
  6      3.4160000              0.347569E+00     
  7      0.4523000             -0.523882E-02     
P   7
  1    761.8000000             -0.667211E-03     
  2    180.2000000             -0.532717E-02     
  3     57.5000000             -0.255494E-01     
  4     21.2400000             -0.757197E-01     
  5      8.3880000             -0.141133E+00     
  6      3.4160000             -0.932768E-01     
  7      0.4523000              0.562450E+00     
P   1
  1      1.2060000              1.0000000        
P   1
  1      0.1545000              1.0000000        
D   1
  1      0.4100000              1.0000000        
D   1
  1      1.2540000              1.0000000        
F   1
  1      0.8900000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ca
data:
CALCIUM
S   18
  1 2402654.0000000             0.00000931       
  2 359789.8000000              0.00007239       
  3  81878.0900000              0.00038059       
  4  23190.8900000              0.00160453       
  5   7565.2120000              0.00580780       
  6   2730.7020000              0.01859566       
  7   1064.6400000              0.05287776       
  8    441.0605000              0.13015149       
  9    191.7269000              0.25931471       
 10     86.5377400              0.36149610       
 11     39.8992400              0.26411160       
 12     17.6406500              0.05709398       
 13      8.3599900             -0.00182200       
 14      3.9513300              0.00211164       
 15      1.7134000             -0.00097709       
 16      0.8108600              0.00045581       
 17      0.3602500             -0.00019146       
 18      0.0448400             -0.00007874       
S   18
  1 2402654.0000000            -0.00000270       
  2 359789.8000000             -0.00002102       
  3  81878.0900000             -0.00011052       
  4  23190.8900000             -0.00046666       
  5   7565.2120000             -0.00169513       
  6   2730.7020000             -0.00548346       
  7   1064.6400000             -0.01596597       
  8    441.0605000             -0.04151384       
  9    191.7269000             -0.09286387       
 10     86.5377400             -0.16531657       
 11     39.8992400             -0.17664074       
 12     17.6406500              0.06444422       
 13      8.3599900              0.51087962       
 14      3.9513300              0.49463804       
 15      1.7134000              0.08750094       
 16      0.8108600             -0.00359101       
 17      0.3602500              0.00249220       
 18      0.0448400              0.00064587       
S   18
  1 2402654.0000000             0.00000093       
  2 359789.8000000              0.00000725       
  3  81878.0900000              0.00003811       
  4  23190.8900000              0.00016101       
  5   7565.2120000              0.00058466       
  6   2730.7020000              0.00189504       
  7   1064.6400000              0.00552525       
  8    441.0605000              0.01447010       
  9    191.7269000              0.03271581       
 10     86.5377400              0.06003190       
 11     39.8992400              0.06701683       
 12     17.6406500             -0.02593660       
 13      8.3599900             -0.26747467       
 14      3.9513300             -0.42697256       
 15      1.7134000              0.06796405       
 16      0.8108600              0.71020539       
 17      0.3602500              0.44180057       
 18      0.0448400             -0.01186924       
S   18
  1 2402654.0000000            -0.00000022       
  2 359789.8000000             -0.00000173       
  3  81878.0900000             -0.00000910       
  4  23190.8900000             -0.00003844       
  5   7565.2120000             -0.00013965       
  6   2730.7020000             -0.00045251       
  7   1064.6400000             -0.00132038       
  8    441.0605000             -0.00345841       
  9    191.7269000             -0.00783686       
 10     86.5377400             -0.01441517       
 11     39.8992400             -0.01621648       
 12     17.6406500              0.00634420       
 13      8.3599900              0.06740626       
 14      3.9513300              0.11447396       
 15      1.7134000             -0.02634477       
 16      0.8108600             -0.23369885       
 17      0.3602500             -0.31607538       
 18      0.0448400              0.56111035       
S   1
  1      0.0810800              1.0000000        
S   1
  1      0.0214300              1.0000000        
P   12
  1   4061.2890000              0.00019799       
  2    962.2465000              0.00173208       
  3    312.1686000              0.00953379       
  4    118.7144000              0.03839012       
  5     49.8067000              0.11675881       
  6     22.2599800              0.25626874       
  7     10.2876400              0.37978080       
  8      4.8611540              0.30829326       
  9      2.2487730              0.08592090       
 10      1.0336620              0.00212067       
 11      0.4641320              0.00128880       
 12      0.0673900              0.00014728       
P   12
  1   4061.2890000             -0.00006455       
  2    962.2465000             -0.00056458       
  3    312.1686000             -0.00313125       
  4    118.7144000             -0.01274086       
  5     49.8067000             -0.03991403       
  6     22.2599800             -0.09050448       
  7     10.2876400             -0.14261898       
  8      4.8611540             -0.10980904       
  9      2.2487730              0.15162490       
 10      1.0336620              0.46176411       
 11      0.4641320              0.43260031       
 12      0.0673900              0.00252874       
P   12
  1   4061.2890000              0.00001336       
  2    962.2465000              0.00011852       
  3    312.1686000              0.00064872       
  4    118.7144000              0.00267993       
  5     49.8067000              0.00828513       
  6     22.2599800              0.01921235       
  7     10.2876400              0.02954984       
  8      4.8611540              0.02431232       
  9      2.2487730             -0.04111230       
 10      1.0336620             -0.10419758       
 11      0.4641320             -0.15036537       
 12      0.0673900              0.59861164       
P   1
  1      0.1987500              1.0000000        
P   1
  1      0.0254200              1.0000000        
D   4
  1     16.9462300              0.01547300       
  2      4.4721200              0.07887400       
  3      1.4380900              0.20878000       
  4      0.4669900              0.33021300       
D   1
  1      0.1415100              1.0000000        
D   1
  1      0.0416400              1.0000000        
F   1
  1      0.1509000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Sc
data:
SCANDIUM
S   19
  1 2715278.0000000             8.147221E-06     
  2 406598.4000000              6.334788E-05     
  3  92530.0400000              0.0003330384     
  4  26207.9200000              0.001404055      
  5   8549.4290000              0.005081725      
  6   3085.9750000              0.01626926       
  7   1203.1720000              0.04624577       
  8    498.4869000              0.1137223        
  9    216.7360000              0.2257636        
 10     97.8747600              0.3106700        
 11     45.2043300              0.2191906        
 12     20.2118700              0.07215879       
 13      9.5747510              0.1187030        
 14      4.5403460              0.1220532        
 15      1.9956870              0.02136795       
 16      0.9422150             -0.0005357246     
 17      0.4178450              0.0002435774     
 18      0.0957610             -8.796617E-05     
 19      0.0513510              7.878246E-05     
S   19
  1 2715278.0000000            -4.722109E-06     
  2 406598.4000000             -3.671829E-05     
  3  92530.0400000             -0.0001930883     
  4  26207.9200000             -0.000814687      
  5   8549.4290000             -0.002955526      
  6   3085.9750000             -0.009520035      
  7   1203.1720000             -0.02746858       
  8    498.4869000             -0.06991528       
  9    216.7360000             -0.1499251        
 10     97.8747600             -0.2459153        
 11     45.2043300             -0.2401293        
 12     20.2118700              0.03567987       
 13      9.5747510              0.4915023        
 14      4.5403460              0.4911381        
 15      1.9956870              0.09120633       
 16      0.9422150             -0.005356723      
 17      0.4178450              0.0008812836     
 18      0.0957610             -0.0007605536     
 19      0.0513510              0.0006340116     
S   19
  1 2715278.0000000             9.139905E-07     
  2 406598.4000000              7.108513E-06     
  3  92530.0400000              3.738126E-05     
  4  26207.9200000              0.0001578828     
  5   8549.4290000              0.0005737686     
  6   3085.9750000              0.001859244      
  7   1203.1720000              0.005433182      
  8    498.4869000              0.01425387       
  9    216.7360000              0.03246144       
 10     97.8747600              0.06003454       
 11     45.2043300              0.06916105       
 12     20.2118700             -0.02113084       
 13      9.5747510             -0.2666832        
 14      4.5403460             -0.4367591        
 15      1.9956870              0.06498243       
 16      0.9422150              0.7009599        
 17      0.4178450              0.4515562        
 18      0.0957610              0.0301191        
 19      0.0513510             -0.0132948        
S   19
  1 2715278.0000000            -2.201951E-07     
  2 406598.4000000             -1.711419E-06     
  3  92530.0400000             -9.008469E-06     
  4  26207.9200000             -3.799997E-05     
  5   8549.4290000             -0.0001383227     
  6   3085.9750000             -0.0004473692     
  7   1203.1720000             -0.001310691      
  8    498.4869000             -0.00342986       
  9    216.7360000             -0.007847579      
 10     97.8747600             -0.01447189       
 11     45.2043300             -0.01690669       
 12     20.2118700              0.005396115      
 13      9.5747510              0.06671062       
 14      4.5403460              0.1178356        
 15      1.9956870             -0.02738134       
 16      0.9422150             -0.2260149        
 17      0.4178450             -0.3073539        
 18      0.0957610              0.2544054        
 19      0.0513510              0.5981590        
S   19
  1 2715278.0000000            -3.757238E-07     
  2 406598.4000000             -2.981907E-06     
  3  92530.0400000             -1.522586E-05     
  4  26207.9200000             -6.684686E-05     
  5   8549.4290000             -0.0002313129     
  6   3085.9750000             -0.0007959729     
  7   1203.1720000             -0.002161961      
  8    498.4869000             -0.006206459      
  9    216.7360000             -0.01261905       
 10     97.8747600             -0.02739459       
 11     45.2043300             -0.02336516       
 12     20.2118700             -0.005734627      
 13      9.5747510              0.1536025        
 14      4.5403460              0.1447100        
 15      1.9956870              0.09359699       
 16      0.9422150             -0.8687730        
 17      0.4178450              0.02114597       
 18      0.0957610              2.2754980        
 19      0.0513510             -1.1907700        
S   19
  1 2715278.0000000            -5.962768E-07     
  2 406598.4000000             -4.822853E-06     
  3  92530.0400000             -2.395005E-05     
  4  26207.9200000             -0.0001090335     
  5   8549.4290000             -0.0003601944     
  6   3085.9750000             -0.001311233      
  7   1203.1720000             -0.003322435      
  8    498.4869000             -0.0103752        
  9    216.7360000             -0.01892174       
 10     97.8747600             -0.04755287       
 11     45.2043300             -0.02931692       
 12     20.2118700             -0.03090088       
 13      9.5747510              0.3074597        
 14      4.5403460              0.1803100        
 15      1.9956870              0.2358178        
 16      0.9422150             -2.3885440        
 17      0.4178450              2.3294070        
 18      0.0957610              0.9918252        
 19      0.0513510             -3.5072400        
S   1
  1      0.0238780              1.0000000        
P   15
  1  10592.1900000              0.0000450        
  2   2507.5330000              0.0004010        
  3    814.4571000              0.0023020        
  4    311.5195000              0.0100370        
  5    131.9617000              0.0349540        
  6     59.9871800              0.0979090        
  7     28.6625000              0.2106800        
  8     14.1085100              0.3300930        
  9      7.1037060              0.3310270        
 10      3.6092000              0.1579600        
 11      1.7760700              0.0220990        
 12      0.8547600             -0.0016050        
 13      0.4022390             -0.0013260        
 14      0.1546650             -0.0002800        
 15      0.0649450              0.0000340        
P   15
  1  10592.1900000             -0.0000150        
  2   2507.5330000             -0.0001310        
  3    814.4571000             -0.0007570        
  4    311.5195000             -0.0033180        
  5    131.9617000             -0.0117060        
  6     59.9871800             -0.0336040        
  7     28.6625000             -0.0748790        
  8     14.1085100             -0.1225480        
  9      7.1037060             -0.1302760        
 10      3.6092000              0.0145960        
 11      1.7760700              0.3091840        
 12      0.8547600              0.4629980        
 13      0.4022390              0.3049570        
 14      0.1546650              0.0508780        
 15      0.0649450             -0.0044930        
P   15
  1  10592.1900000             -0.0000040        
  2   2507.5330000             -0.0000320        
  3    814.4571000             -0.0001850        
  4    311.5195000             -0.0008080        
  5    131.9617000             -0.0028700        
  6     59.9871800             -0.0082070        
  7     28.6625000             -0.0184730        
  8     14.1085100             -0.0301010        
  9      7.1037060             -0.0329430        
 10      3.6092000              0.0079580        
 11      1.7760700              0.0879930        
 12      0.8547600              0.1523770        
 13      0.4022390              0.0971700        
 14      0.1546650             -0.2569380        
 15      0.0649450             -0.5878150        
P   15
  1  10592.1900000              0.0000040        
  2   2507.5330000              0.0000390        
  3    814.4571000              0.0002210        
  4    311.5195000              0.0009840        
  5    131.9617000              0.0034230        
  6     59.9871800              0.0099930        
  7     28.6625000              0.0219160        
  8     14.1085100              0.0370080        
  9      7.1037060              0.0377940        
 10      3.6092000             -0.0043790        
 11      1.7760700             -0.1101640        
 12      0.8547600             -0.1610170        
 13      0.4022390             -0.1824820        
 14      0.1546650              0.3886110        
 15      0.0649450              0.6911000        
P   15
  1  10592.1900000              0.0000090        
  2   2507.5330000              0.0000740        
  3    814.4571000              0.0004790        
  4    311.5195000              0.0018690        
  5    131.9617000              0.0074240        
  6     59.9871800              0.0187630        
  7     28.6625000              0.0487170        
  8     14.1085100              0.0654400        
  9      7.1037060              0.1079480        
 10      3.6092000             -0.0587130        
 11      1.7760700             -0.1703060        
 12      0.8547600             -0.7549770        
 13      0.4022390              0.6201170        
 14      0.1546650              1.1675480        
 15      0.0649450             -1.0095310        
P   1
  1      0.0263590              1.0000000        
D   7
  1     50.5138000              0.0042660        
  2     14.7405000              0.0277080        
  3      5.1950000              0.1000010        
  4      2.0284600              0.2315810        
  5      0.8040860              0.3460330        
  6      0.3076890              0.3733740        
  7      0.1113920              0.2642880        
D   7
  1     50.5138000             -0.0043890        
  2     14.7405000             -0.0283630        
  3      5.1950000             -0.1051370        
  4      2.0284600             -0.2348540        
  5      0.8040860             -0.3246090        
  6      0.3076890             -0.0642890        
  7      0.1113920              0.6017490        
D   7
  1     50.5138000              0.0058590        
  2     14.7405000              0.0373230        
  3      5.1950000              0.1419240        
  4      2.0284600              0.3068960        
  5      0.8040860              0.3081890        
  6      0.3076890             -0.7607170        
  7      0.1113920             -0.2047750        
D   1
  1      0.0373520              1.0000000        
F   1
  1      0.7267000              1.0000000        
F   1
  1      0.1665000              1.0000000        
G   1
  1      0.4187000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ti
data:
TITANIUM
S   19
  1 3014643.0000000             8.060782E-06     
  2 451432.9000000              6.267518E-05     
  3 102733.8000000              0.0003295006     
  4  29098.1700000              0.001389203      
  5   9492.3300000              0.005028469      
  6   3426.3460000              0.01610419       
  7   1335.8960000              0.04581232       
  8    553.5026000              0.1128613        
  9    240.6925000              0.2248193        
 10    108.7293000              0.3114571        
 11     50.2645700              0.2224995        
 12     22.5800400              0.07293128       
 13     10.7143200              0.1160683        
 14      5.0935460              0.1194774        
 15      2.2441830              0.02097868       
 16      1.0595700             -0.0005091715     
 17      0.4688490              0.0002217859     
 18      0.1061430             -7.636896E-05     
 19      0.0552620              7.719539E-05     
S   19
  1 3014643.0000000            -4.630486E-06     
  2 451432.9000000             -3.600451E-05     
  3 102733.8000000             -0.000189342      
  4  29098.1700000             -0.0007988781     
  5   9492.3300000             -0.002898698      
  6   3426.3460000             -0.009339701      
  7   1335.8960000             -0.02697464       
  8    553.5026000             -0.06878913       
  9    240.6925000             -0.1481037        
 10    108.7293000             -0.2445253        
 11     50.2645700             -0.2419916        
 12     22.5800400              0.0318379        
 13     10.7143200              0.4932686        
 14      5.0935460              0.4939655        
 15      2.2441830              0.09196313       
 16      1.0595700             -0.005316992      
 17      0.4688490              0.0008085624     
 18      0.1061430             -0.0006918459     
 19      0.0552620              0.0006086512     
S   19
  1 3014643.0000000             9.230559E-07     
  2 451432.9000000              7.178974E-06     
  3 102733.8000000              3.775134E-05     
  4  29098.1700000              0.0001594532     
  5   9492.3300000              0.000579515      
  6   3426.3460000              0.001878414      
  7   1335.8960000              0.005492747      
  8    553.5026000              0.01443297       
  9    240.6925000              0.03296408       
 10    108.7293000              0.06125493       
 11     50.2645700              0.07134113       
 12     22.5800400             -0.0197315        
 13     10.7143200             -0.2741869        
 14      5.0935460             -0.4440977        
 15      2.2441830              0.07776084       
 16      1.0595700              0.7068444        
 17      0.4688490              0.4413892        
 18      0.1061430              0.02799769       
 19      0.0552620             -0.0121079        
S   19
  1 3014643.0000000            -2.180323E-07     
  2 451432.9000000             -1.69486E-06      
  3 102733.8000000             -8.919208E-06     
  4  29098.1700000             -3.763633E-05     
  5   9492.3300000             -0.0001369575     
  6   3426.3460000             -0.0004432894     
  7   1335.8960000             -0.001298868      
  8    553.5026000             -0.003406752      
  9    240.6925000             -0.007810829      
 10    108.7293000             -0.01449245       
 11     50.2645700             -0.01708136       
 12     22.5800400              0.004897666      
 13     10.7143200              0.06753108       
 14      5.0935460              0.1173318        
 15      2.2441830             -0.02985025       
 16      1.0595700             -0.2277634        
 17      0.4688490             -0.2928115        
 18      0.1061430              0.2665300        
 19      0.0552620              0.5912406        
S   19
  1 3014643.0000000            -3.975126E-07     
  2 451432.9000000             -3.16108E-06      
  3 102733.8000000             -1.609375E-05     
  4  29098.1700000             -7.092947E-05     
  5   9492.3300000             -0.000244271      
  6   3426.3460000             -0.0008457892     
  7   1335.8960000             -0.002282208      
  8    553.5026000             -0.006619873      
  9    240.6925000             -0.01335024       
 10    108.7293000             -0.0295583        
 11     50.2645700             -0.02477039       
 12     22.5800400             -0.008414624      
 13     10.7143200              0.1693855        
 14      5.0935460              0.1500787        
 15      2.2441830              0.09787777       
 16      1.0595700             -0.9653608        
 17      0.4688490              0.1489721        
 18      0.1061430              2.1911790        
 19      0.0552620             -1.2433250        
S   19
  1 3014643.0000000            -6.302483E-07     
  2 451432.9000000             -5.084585E-06     
  3 102733.8000000             -2.534482E-05     
  4  29098.1700000             -0.000114826      
  5   9492.3300000             -0.0003817497     
  6   3426.3460000             -0.001379645      
  7   1335.8960000             -0.003531666      
  8    553.5026000             -0.01092225       
  9    240.6925000             -0.02029554       
 10    108.7293000             -0.05024404       
 11     50.2645700             -0.03316309       
 12     22.5800400             -0.03098063       
 13     10.7143200              0.3244673        
 14      5.0935460              0.2155689        
 15      2.2441830              0.1499616        
 16      1.0595700             -2.4207410        
 17      0.4688490              2.5308740        
 18      0.1061430              0.3423600        
 19      0.0552620             -2.7337220        
S   1
  1      0.0254650              1.0000000        
P   15
  1  11912.0300000              0.0000440        
  2   2819.9470000              0.0003910        
  3    915.9479000              0.0022480        
  4    350.3842000              0.0098230        
  5    148.4825000              0.0343380        
  6     67.5394400              0.0966660        
  7     32.3033200              0.2094170        
  8     15.9278600              0.3301890        
  9      8.0380350              0.3319360        
 10      4.0939160              0.1584880        
 11      2.0223900              0.0223100        
 12      0.9761020             -0.0015660        
 13      0.4595950             -0.0013240        
 14      0.1771520             -0.0002710        
 15      0.0735170              0.0000320        
P   15
  1  11912.0300000             -0.0000150        
  2   2819.9470000             -0.0001310        
  3    915.9479000             -0.0007550        
  4    350.3842000             -0.0033190        
  5    148.4825000             -0.0117500        
  6     67.5394400             -0.0339220        
  7     32.3033200             -0.0761640        
  8     15.9278600             -0.1257020        
  9      8.0380350             -0.1330980        
 10      4.0939160              0.0174060        
 11      2.0223900              0.3151650        
 12      0.9761020              0.4618140        
 13      0.4595950              0.2998560        
 14      0.1771520              0.0500000        
 15      0.0735170             -0.0042300        
P   15
  1  11912.0300000              0.0000040        
  2   2819.9470000              0.0000310        
  3    915.9479000              0.0001820        
  4    350.3842000              0.0007950        
  5    148.4825000              0.0028330        
  6     67.5394400              0.0081540        
  7     32.3033200              0.0184720        
  8     15.9278600              0.0304000        
  9      8.0380350              0.0330470        
 10      4.0939160             -0.0082510        
 11      2.0223900             -0.0885540        
 12      0.9761020             -0.1496120        
 13      0.4595950             -0.0942270        
 14      0.1771520              0.2508460        
 15      0.0735170              0.5866430        
P   15
  1  11912.0300000              0.0000040        
  2   2819.9470000              0.0000390        
  3    915.9479000              0.0002230        
  4    350.3842000              0.0009920        
  5    148.4825000              0.0034760        
  6     67.5394400              0.0101720        
  7     32.3033200              0.0225760        
  8     15.9278600              0.0382380        
  9      8.0380350              0.0393370        
 10      4.0939160             -0.0061060        
 11      2.0223900             -0.1129620        
 12      0.9761020             -0.1681140        
 13      0.4595950             -0.1659320        
 14      0.1771520              0.3914030        
 15      0.0735170              0.6818400        
P   15
  1  11912.0300000              0.0000090        
  2   2819.9470000              0.0000730        
  3    915.9479000              0.0004680        
  4    350.3842000              0.0018560        
  5    148.4825000              0.0072930        
  6     67.5394400              0.0188560        
  7     32.3033200              0.0484050        
  8     15.9278600              0.0673780        
  9      8.0380350              0.1045410        
 10      4.0939160             -0.0537600        
 11      2.0223900             -0.1917490        
 12      0.9761020             -0.6947200        
 13      0.4595950              0.5601620        
 14      0.1771520              1.1813360        
 15      0.0735170             -0.9932720        
P   1
  1      0.0294010              1.0000000        
D   7
  1     64.0130000              0.0038870        
  2     18.8179000              0.0263990        
  3      6.7287000              0.0975110        
  4      2.6641300              0.2328480        
  5      1.0786800              0.3531520        
  6      0.4232090              0.3721860        
  7      0.1559990              0.2476720        
D   7
  1     64.0130000             -0.0039700        
  2     18.8179000             -0.0268730        
  3      6.7287000             -0.1022750        
  4      2.6641300             -0.2377280        
  5      1.0786800             -0.3121140        
  6      0.4232090             -0.0423780        
  7      0.1559990              0.5886580        
D   7
  1     64.0130000              0.0064180        
  2     18.8179000              0.0438090        
  3      6.7287000              0.1723250        
  4      2.6641300              0.3753320        
  5      1.0786800              0.2249470        
  6      0.4232090             -0.7919070        
  7      0.1559990             -0.1044280        
D   1
  1      0.0518840              1.0000000        
F   1
  1      1.2483000              1.0000000        
F   1
  1      0.2836000              1.0000000        
G   1
  1      0.7251000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: V
data:
VANADIUM
S   19
  1 3321857.0000000             8.039999E-06     
  2 497435.6000000              6.251402E-05     
  3 113202.7000000              0.0003286553     
  4  32063.3300000              0.001385697      
  5  10459.6200000              0.005016217      
  6   3775.5060000              0.01606931       
  7   1472.0400000              0.04574242       
  8    609.9331000              0.1128544        
  9    265.2634000              0.2254344        
 10    119.8607000              0.3140461        
 11     55.4489100              0.2267819        
 12     24.9837200              0.07334069       
 13     11.8805600              0.1102474        
 14      5.6603110              0.1131358        
 15      2.4957030              0.01971295       
 16      1.1778660             -0.0004719088     
 17      0.5200440              0.0001861606     
 18      0.1159650             -6.208598E-05     
 19      0.0589380              7.295314E-05     
S   19
  1 3321857.0000000            -4.503003E-06     
  2 497435.6000000             -3.501295E-05     
  3 113202.7000000             -0.0001841339     
  4  32063.3300000             -0.0007769216     
  5  10459.6200000             -0.002819505      
  6   3775.5060000             -0.009087486      
  7   1472.0400000             -0.02627134       
  8    609.9331000             -0.06712726       
  9    265.2634000             -0.1451130        
 10    119.8607000             -0.2412483        
 11     55.4489100             -0.2416314        
 12     24.9837200              0.03067362       
 13     11.8805600              0.4970415        
 14      5.6603110              0.4958875        
 15      2.4957030              0.09181868       
 16      1.1778660             -0.005392514      
 17      0.5200440              0.000710238      
 18      0.1159650             -0.0006363128     
 19      0.0589380              0.0005979932     
S   19
  1 3321857.0000000             9.320648E-07     
  2 497435.6000000              7.249306E-06     
  3 113202.7000000              3.811967E-05     
  4  32063.3300000              0.0001610238     
  5  10459.6200000              0.000585221      
  6   3775.5060000              0.001897502      
  7   1472.0400000              0.005550909      
  8    609.9331000              0.01460584       
  9    265.2634000              0.03342974       
 10    119.8607000              0.06235722       
 11     55.4489100              0.07312435       
 12     24.9837200             -0.01911472       
 13     11.8805600             -0.2817249        
 14      5.6603110             -0.4488151        
 15      2.4957030              0.09202696       
 16      1.1778660              0.7110117        
 17      0.5200440              0.4309274        
 18      0.1159650              0.02604589       
 19      0.0589380             -0.01101049       
S   19
  1 3321857.0000000            -2.158944E-07     
  2 497435.6000000             -1.678519E-06     
  3 113202.7000000             -8.831213E-06     
  4  32063.3300000             -3.727769E-05     
  5  10459.6200000             -0.0001356099     
  6   3775.5060000             -0.0004392351     
  7   1472.0400000             -0.001286948      
  8    609.9331000             -0.003382149      
  9    265.2634000             -0.007765646      
 10    119.8607000             -0.01447985       
 11     55.4489100             -0.01715502       
 12     24.9837200              0.004610101      
 13     11.8805600              0.06827831       
 14      5.6603110              0.1161368        
 15      2.4957030             -0.03277049       
 16      1.1778660             -0.2280000        
 17      0.5200440             -0.2793991        
 18      0.1159650              0.2771165        
 19      0.0589380              0.5852999        
S   19
  1 3321857.0000000            -4.093416E-07     
  2 497435.6000000             -3.258956E-06     
  3 113202.7000000             -1.65639E-05      
  4  32063.3300000             -7.316689E-05     
  5  10459.6200000             -0.0002512784     
  6   3775.5060000             -0.0008732657     
  7   1472.0400000             -0.002347654      
  8    609.9331000             -0.00685315       
  9    265.2634000             -0.0137642        
 10    119.8607000             -0.03084679       
 11     55.4489100             -0.02562208       
 12     24.9837200             -0.01005123       
 13     11.8805600              0.1795330        
 14      5.6603110              0.1522400        
 15      2.4957030              0.09483887       
 16      1.1778660             -1.0148760        
 17      0.5200440              0.2308810        
 18      0.1159650              2.1133210        
 19      0.0589380             -1.2530480        
S   19
  1 3321857.0000000            -6.539963E-07     
  2 497435.6000000             -5.267399E-06     
  3 113202.7000000             -2.632092E-05     
  4  32063.3300000             -0.0001188719     
  5  10459.6200000             -0.0003968552     
  6   3775.5060000             -0.00142746       
  7   1472.0400000             -0.003679181      
  8    609.9331000             -0.01130774       
  9    265.2634000             -0.02128221       
 10    119.8607000             -0.05218271       
 11     55.4489100             -0.03599014       
 12     24.9837200             -0.03088759       
 13     11.8805600              0.3380657        
 14      5.6603110              0.2389559        
 15      2.4957030              0.07609068       
 16      1.1778660             -2.4081130        
 17      0.5200440              2.6335920        
 18      0.1159650             -0.0535851        
 19      0.0589380             -2.2301350        
S   1
  1      0.0269460              1.0000000        
P   15
  1  13273.2000000              0.0000430        
  2   3142.1260000              0.0003840        
  3   1020.5880000              0.0022100        
  4    390.4407000              0.0096780        
  5    165.5043000              0.0339360        
  6     75.3200600              0.0959170        
  7     36.0550300              0.2088530        
  8     17.8043600              0.3306600        
  9      9.0029290              0.3323120        
 10      4.5945440              0.1581880        
 11      2.2767600              0.0222520        
 12      1.1011780             -0.0015650        
 13      0.5186380             -0.0013530        
 14      0.2005650             -0.0002650        
 15      0.0812910              0.0000290        
P   15
  1  13273.2000000             -0.0000150        
  2   3142.1260000             -0.0001310        
  3   1020.5880000             -0.0007550        
  4    390.4407000             -0.0033250        
  5    165.5043000             -0.0118110        
  6     75.3200600             -0.0342560        
  7     36.0550300             -0.0773630        
  8     17.8043600             -0.1284560        
  9      9.0029290             -0.1350780        
 10      4.5945440              0.0208380        
 11      2.2767600              0.3204990        
 12      1.1011780              0.4602600        
 13      0.5186380              0.2953460        
 14      0.2005650              0.0490460        
 15      0.0812910             -0.0038240        
P   15
  1  13273.2000000              0.0000040        
  2   3142.1260000              0.0000320        
  3   1020.5880000              0.0001830        
  4    390.4407000              0.0008020        
  5    165.5043000              0.0028620        
  6     75.3200600              0.0082870        
  7     36.0550300              0.0188700        
  8     17.8043600              0.0313070        
  9      9.0029290              0.0336600        
 10      4.5945440             -0.0094790        
 11      2.2767600             -0.0923130        
 12      1.1011780             -0.1489890        
 13      0.5186380             -0.0836440        
 14      0.2005650              0.2493390        
 15      0.0812910              0.5805150        
P   15
  1  13273.2000000              0.0000040        
  2   3142.1260000              0.0000390        
  3   1020.5880000              0.0002230        
  4    390.4407000              0.0009960        
  5    165.5043000              0.0034980        
  6     75.3200600              0.0102960        
  7     36.0550300              0.0229620        
  8     17.8043600              0.0392080        
  9      9.0029290              0.0399430        
 10      4.5945440             -0.0071210        
 11      2.2767600             -0.1162250        
 12      1.1011780             -0.1694960        
 13      0.5186380             -0.1553740        
 14      0.2005650              0.3950220        
 15      0.0812910              0.6789080        
P   15
  1  13273.2000000              0.0000090        
  2   3142.1260000              0.0000750        
  3   1020.5880000              0.0004790        
  4    390.4407000              0.0019060        
  5    165.5043000              0.0075120        
  6     75.3200600              0.0195300        
  7     36.0550300              0.0504020        
  8     17.8043600              0.0706850        
  9      9.0029290              0.1087750        
 10      4.5945440             -0.0585360        
 11      2.2767600             -0.2154480        
 12      1.1011780             -0.6773420        
 13      0.5186380              0.5859790        
 14      0.2005650              1.1291080        
 15      0.0812910             -0.9740510        
P   1
  1      0.0317950              1.0000000        
D   7
  1     77.6115000              0.0035950        
  2     22.9159000              0.0252100        
  3      8.2795400              0.0947860        
  4      3.3099300              0.2303630        
  5      1.3586300              0.3528940        
  6      0.5413500              0.3704140        
  7      0.2023560              0.2457180        
D   7
  1     77.6115000             -0.0038180        
  2     22.9159000             -0.0267170        
  3      8.2795400             -0.1036900        
  4      3.3099300             -0.2476890        
  5      1.3586300             -0.3115230        
  6      0.5413500             -0.0228270        
  7      0.2023560              0.5697260        
D   7
  1     77.6115000              0.0060010        
  2     22.9159000              0.0422060        
  3      8.2795400              0.1707510        
  4      3.3099300              0.3855180        
  5      1.3586300              0.2062040        
  6      0.5413500             -0.7786690        
  7      0.2023560             -0.1147210        
D   1
  1      0.0675680              1.0000000        
F   1
  1      1.7749000              1.0000000        
F   1
  1      0.4125000              1.0000000        
G   1
  1      1.1368000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Cr
data:
CHROMIUM
S   19
  1 6177194.0000000             4.128667E-06     
  2 924929.5000000              3.210767E-05     
  3 210486.5000000              0.0001688416     
  4  59620.0500000              0.000712852      
  5  19450.7600000              0.002589325      
  6   7022.0560000              0.00837735       
  7   2738.7630000              0.02441725       
  8   1135.8140000              0.06365135       
  9    495.0923000              0.1427618        
 10    224.7487000              0.2541275        
 11    105.3836000              0.3009512        
 12     50.1935900              0.1766513        
 13     22.2495700              0.06936709       
 14     10.9826500              0.1179579        
 15      5.3836650              0.08916187       
 16      2.3436850              0.0110363        
 17      1.1052020             -0.0003546048     
 18      0.4878480              0.0001057311     
 19      0.0895990              1.11464E-05      
S   19
  1 6177194.0000000            -2.301772E-06     
  2 924929.5000000             -1.789536E-05     
  3 210486.5000000             -9.416174E-05     
  4  59620.0500000             -0.0003975074     
  5  19450.7600000             -0.001447025      
  6   7022.0560000             -0.004694622      
  7   2738.7630000             -0.01382387       
  8   1135.8140000             -0.03674643       
  9    495.0923000             -0.08647185       
 10    224.7487000             -0.1696735        
 11    105.3836000             -0.2507089        
 12     50.1935900             -0.1961156        
 13     22.2495700              0.1457244        
 14     10.9826500              0.5466706        
 15      5.3836650              0.3979434        
 16      2.3436850              0.05277007       
 17      1.1052020             -0.004374537      
 18      0.4878480              0.0003204035     
 19      0.0895990             -5.142077E-05     
S   19
  1 6177194.0000000             4.862957E-07     
  2 924929.5000000              3.776645E-06     
  3 210486.5000000              1.990664E-05     
  4  59620.0500000              8.389164E-05     
  5  19450.7600000              0.0003065706     
  6   7022.0560000              0.0009944107     
  7   2738.7630000              0.002961959      
  8   1135.8140000              0.007969473      
  9    495.0923000              0.01955017       
 10    224.7487000              0.04085035       
 11    105.3836000              0.06929003       
 12     50.1935900              0.06146984       
 13     22.2495700             -0.06981302       
 14     10.9826500             -0.3517597        
 15      5.3836650             -0.3828629        
 16      2.3436850              0.2676401        
 17      1.1052020              0.7175950        
 18      0.4878480              0.3020814        
 19      0.0895990              0.007749514      
S   19
  1 6177194.0000000            -1.102451E-07     
  2 924929.5000000             -8.530233E-07     
  3 210486.5000000             -4.520358E-06     
  4  59620.0500000             -1.891612E-05     
  5  19450.7600000             -6.974344E-05     
  6   7022.0560000             -0.0002237867     
  7   2738.7630000             -0.0006754503     
  8   1135.8140000             -0.001789346      
  9    495.0923000             -0.004477858      
 10    224.7487000             -0.009140144      
 11    105.3836000             -0.01610562       
 12     50.1935900             -0.0133487        
 13     22.2495700              0.01426027       
 14     10.9826500              0.0893169        
 15      5.3836650              0.08885279       
 16      2.3436850             -0.06368776       
 17      1.1052020             -0.2783262        
 18      0.4878480             -0.1830071        
 19      0.0895990              0.6790937        
S   19
  1 6177194.0000000             2.179893E-07     
  2 924929.5000000              1.61294E-06      
  3 210486.5000000              9.111842E-06     
  4  59620.0500000              3.500645E-05     
  5  19450.7600000              0.0001435315     
  6   7022.0560000              0.0004035896     
  7   2738.7630000              0.001425177      
  8   1135.8140000              0.003114009      
  9    495.0923000              0.009814449      
 10    224.7487000              0.01474698       
 11    105.3836000              0.03911512       
 12     50.1935900              0.009170888      
 13     22.2495700              0.01559878       
 14     10.9826500             -0.2816844        
 15      5.3836650             -0.006895261      
 16      2.3436850             -0.1769781        
 17      1.1052020              1.4430610        
 18      0.4878480             -1.0293180        
 19      0.0895990             -1.3076670        
S   19
  1 6177194.0000000            -3.669010E-07     
  2 924929.5000000             -2.768353E-06     
  3 210486.5000000             -1.521014E-05     
  4  59620.0500000             -6.066288E-05     
  5  19450.7600000             -0.0002374959     
  6   7022.0560000             -0.0007077071     
  7   2738.7630000             -0.002334389      
  8   1135.8140000             -0.005555062      
  9    495.0923000             -0.01585142       
 10    224.7487000             -0.02737888       
 11    105.3836000             -0.06106975       
 12     50.1935900             -0.02887227       
 13     22.2495700              0.006813714      
 14     10.9826500              0.4327670        
 15      5.3836650              0.1968410        
 16      2.3436850             -0.3764657        
 17      1.1052020             -2.0524730        
 18      0.4878480              2.9757410        
 19      0.0895990             -2.2117050        
S   1
  1      0.0334230              1.0000000        
P   15
  1  14454.2000000              0.0000440        
  2   3421.6760000              0.0003890        
  3   1111.3870000              0.0022410        
  4    425.1918000              0.0098210        
  5    180.2623000              0.0344710        
  6     82.0611700              0.0974600        
  7     39.2972600              0.2119850        
  8     19.4195900              0.3339900        
  9      9.8288990              0.3301370        
 10      5.0168100              0.1522270        
 11      2.4870910              0.0204250        
 12      1.1987800             -0.0013600        
 13      0.5586950             -0.0011950        
 14      0.2089240             -0.0001970        
 15      0.0846080              0.0000230        
P   15
  1  14454.2000000             -0.0000150        
  2   3421.6760000             -0.0001350        
  3   1111.3870000             -0.0007770        
  4    425.1918000             -0.0034270        
  5    180.2623000             -0.0121890        
  6     82.0611700             -0.0353880        
  7     39.2972600             -0.0799150        
  8     19.4195900             -0.1323350        
  9      9.8288990             -0.1354010        
 10      5.0168100              0.0320080        
 11      2.4870910              0.3338490        
 12      1.1987800              0.4617730        
 13      0.5586950              0.2812900        
 14      0.2089240              0.0418430        
 15      0.0846080             -0.0040020        
P   15
  1  14454.2000000              0.0000040        
  2   3421.6760000              0.0000320        
  3   1111.3870000              0.0001850        
  4    425.1918000              0.0008100        
  5    180.2623000              0.0029060        
  6     82.0611700              0.0083910        
  7     39.2972600              0.0191930        
  8     19.4195900              0.0315640        
  9      9.8288990              0.0334170        
 10      5.0168100             -0.0129070        
 11      2.4870910             -0.0936590        
 12      1.1987800             -0.1499770        
 13      0.5586950             -0.0672340        
 14      0.2089240              0.2707590        
 15      0.0846080              0.5758070        
P   15
  1  14454.2000000              0.0000040        
  2   3421.6760000              0.0000400        
  3   1111.3870000              0.0002290        
  4    425.1918000              0.0010190        
  5    180.2623000              0.0036020        
  6     82.0611700              0.0105500        
  7     39.2972600              0.0237020        
  8     19.4195900              0.0399880        
  9      9.8288990              0.0404370        
 10      5.0168100             -0.0120740        
 11      2.4870910             -0.1189390        
 12      1.1987800             -0.1781000        
 13      0.5586950             -0.1238650        
 14      0.2089240              0.4297220        
 15      0.0846080              0.6507860        
P   15
  1  14454.2000000              0.0000100        
  2   3421.6760000              0.0000790        
  3   1111.3870000              0.0005120        
  4    425.1918000              0.0020230        
  5    180.2623000              0.0080550        
  6     82.0611700              0.0207720        
  7     39.2972600              0.0542240        
  8     19.4195900              0.0746850        
  9      9.8288990              0.1159890        
 10      5.0168100             -0.0765840        
 11      2.4870910             -0.2439310        
 12      1.1987800             -0.6801810        
 13      0.5586950              0.7336640        
 14      0.2089240              0.9991200        
 15      0.0846080             -1.0170810        
P   1
  1      0.0332580              1.0000000        
D   7
  1     88.5768000              0.0036210        
  2     26.2045000              0.0257660        
  3      9.5174700              0.0975560        
  4      3.8224800              0.2363120        
  5      1.5751200              0.3582860        
  6      0.6289280              0.3685430        
  7      0.2344240              0.2354940        
D   7
  1     88.5768000             -0.0041220        
  2     26.2045000             -0.0293070        
  3      9.5174700             -0.1150620        
  4      3.8224800             -0.2730680        
  5      1.5751200             -0.3144230        
  6      0.6289280              0.0420970        
  7      0.2344240              0.5914030        
D   7
  1     88.5768000              0.0059540        
  2     26.2045000              0.0425320        
  3      9.5174700              0.1745110        
  4      3.8224800              0.3939000        
  5      1.5751200              0.1492790        
  6      0.6289280             -0.8102450        
  7      0.2344240              0.0109110        
D   1
  1      0.0768150              1.0000000        
F   1
  1      2.2510000              1.0000000        
F   1
  1      0.5315000              1.0000000        
G   1
  1      1.4459000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Mn
data:
MANGANESE
S   19
  1 3960805.0000000             8.242127E-06     
  2 593115.5000000              6.408587E-05     
  3 134976.8000000              0.0003369253     
  4  38230.6700000              0.001420648      
  5  12471.5400000              0.005143683      
  6   4501.7430000              0.01648569       
  7   1755.2120000              0.0469856        
  8    727.3039000              0.1162437        
  9    316.3678000              0.2335277        
 10    143.0098000              0.3292837        
 11     66.2180500              0.2440304        
 12     29.9189600              0.07219806       
 13     14.3031800              0.07687806       
 14      6.8394510              0.07852235       
 15      3.0123740              0.01294109       
 16      1.4188080             -0.0003784873     
 17      0.6236240             -2.503203E-05     
 18      0.1340980             -2.421517E-05     
 19      0.0655480              3.462071E-05     
S   19
  1 3960805.0000000            -3.936095E-06     
  2 593115.5000000             -3.060481E-05     
  3 134976.8000000             -0.0001609626     
  4  38230.6700000             -0.0006792348     
  5  12471.5400000             -0.002466182      
  6   4501.7430000             -0.007957629      
  7   1755.2120000             -0.02307248       
  8    727.3039000             -0.05932956       
  9    316.3678000             -0.1299451        
 10    143.0098000             -0.2212352        
 11     66.2180500             -0.2292550        
 12     29.9189600              0.03580733       
 13     14.3031800              0.5107602        
 14      6.8394510              0.5008307        
 15      3.0123740              0.0901183        
 16      1.4188080             -0.006909909      
 17      0.6236240             -0.0001912925     
 18      0.1340980             -0.0006032312     
 19      0.0655480              0.0005621608     
S   19
  1 3960805.0000000             9.462709E-07     
  2 593115.5000000              7.360584E-06     
  3 134976.8000000              3.869935E-05     
  4  38230.6700000              0.000163511      
  5  12471.5400000              0.0005941775     
  6   4501.7430000              0.001927737      
  7   1755.2120000              0.005641731      
  8    727.3039000              0.01487848       
  9    316.3678000              0.03414783       
 10    143.0098000              0.06405794       
 11     66.2180500              0.07557659       
 12     29.9189600             -0.0194607        
 13     14.3031800             -0.2957874        
 14      6.8394510             -0.4521170        
 15      3.0123740              0.1224531        
 16      1.4188080              0.7169756        
 17      0.6236240              0.4092712        
 18      0.1340980              0.02221969       
 19      0.0655480             -0.009011202      
S   19
  1 3960805.0000000            -2.095391E-07     
  2 593115.5000000             -1.629439E-06     
  3 134976.8000000             -8.570592E-06     
  4  38230.6700000             -3.619272E-05     
  5  12471.5400000             -0.0001316146     
  6   4501.7430000             -0.000426681      
  7   1755.2120000             -0.00125027       
  8    727.3039000             -0.003294665      
  9    316.3678000             -0.00758186       
 10    143.0098000             -0.01422864       
 11     66.2180500             -0.01693796       
 12     29.9189600              0.004454298      
 13     14.3031800              0.06867042       
 14      6.8394510              0.1113335        
 15      3.0123740             -0.0390082        
 16      1.4188080             -0.2215755        
 17      0.6236240             -0.2544359        
 18      0.1340980              0.2865866        
 19      0.0655480              0.5755741        
S   19
  1 3960805.0000000            -4.121231E-07     
  2 593115.5000000             -3.282099E-06     
  3 134976.8000000             -1.667433E-05     
  4  38230.6700000             -7.369999E-05     
  5  12471.5400000             -0.0002529495     
  6   4501.7430000             -0.0008801425     
  7   1755.2120000             -0.002365482      
  8    727.3039000             -0.006926354      
  9    316.3678000             -0.01393851       
 10    143.0098000             -0.0314384        
 11     66.2180500             -0.02625749       
 12     29.9189600             -0.01048313       
 13     14.3031800              0.1856472        
 14      6.8394510              0.1524839        
 15      3.0123740              0.07411368       
 16      1.4188080             -1.0180970        
 17      0.6236240              0.2980372        
 18      0.1340980              1.9719890        
 19      0.0655480             -1.1792530        
S   19
  1 3960805.0000000            -6.805493E-07     
  2 593115.5000000             -5.460516E-06     
  3 134976.8000000             -2.743893E-05     
  4  38230.6700000             -0.0001230291     
  5  12471.5400000             -0.0004146269     
  6   4501.7430000             -0.001475151      
  7   1755.2120000             -0.00385914       
  8    727.3039000             -0.01168405       
  9    316.3678000             -0.02257185       
 10    143.0098000             -0.05399759       
 11     66.2180500             -0.04032351       
 12     29.9189600             -0.02742526       
 13     14.3031800              0.3485593        
 14      6.8394510              0.2757818        
 15      3.0123740             -0.05499812       
 16      1.4188080             -2.2925450        
 17      0.6236240              2.6356440        
 18      0.1340980             -0.3379113        
 19      0.0655480             -1.7896070        
S   1
  1      0.0295840              1.0000000        
P   15
  1  16205.8600000              0.0000420        
  2   3836.2740000              0.0003730        
  3   1246.0480000              0.0021490        
  4    476.7535000              0.0094450        
  5    202.1895000              0.0332970        
  6     92.0948700              0.0947590        
  7     44.1472000              0.2081440        
  8     21.8546800              0.3318050        
  9     11.0859600              0.3331750        
 10      5.6741080              0.1576010        
 11      2.8231700              0.0214450        
 12      1.3686210             -0.0025580        
 13      0.6444310             -0.0020270        
 14      0.2483820             -0.0003600        
 15      0.0972550              0.0000340        
P   15
  1  16205.8600000             -0.0000150        
  2   3836.2740000             -0.0001290        
  3   1246.0480000             -0.0007480        
  4    476.7535000             -0.0033080        
  5    202.1895000             -0.0118110        
  6     92.0948700             -0.0345330        
  7     44.1472000             -0.0787850        
  8     21.8546800             -0.1321830        
  9     11.0859600             -0.1371950        
 10      5.6741080              0.0270750        
 11      2.8231700              0.3288910        
 12      1.3686210              0.4572800        
 13      0.6444310              0.2889080        
 14      0.2483820              0.0474330        
 15      0.0972550             -0.0035220        
P   15
  1  16205.8600000              0.0000030        
  2   3836.2740000              0.0000300        
  3   1246.0480000              0.0001720        
  4    476.7535000              0.0007620        
  5    202.1895000              0.0027260        
  6     92.0948700              0.0079760        
  7     44.1472000              0.0182870        
  8     21.8546800              0.0307760        
  9     11.0859600              0.0323730        
 10      5.6741080             -0.0099780        
 11      2.8231700             -0.0905290        
 12      1.3686210             -0.1380040        
 13      0.6444310             -0.0779650        
 14      0.2483820              0.2295600        
 15      0.0972550              0.5761220        
P   15
  1  16205.8600000              0.0000040        
  2   3836.2740000              0.0000400        
  3   1246.0480000              0.0002260        
  4    476.7535000              0.0010130        
  5    202.1895000              0.0035750        
  6     92.0948700              0.0106120        
  7     44.1472000              0.0239020        
  8     21.8546800              0.0412790        
  9     11.0859600              0.0414750        
 10      5.6741080             -0.0094580        
 11      2.8231700             -0.1236950        
 12      1.3686210             -0.1743920        
 13      0.6444310             -0.1291700        
 14      0.2483820              0.4003480        
 15      0.0972550              0.6696460        
P   15
  1  16205.8600000              0.0000100        
  2   3836.2740000              0.0000810        
  3   1246.0480000              0.0005120        
  4    476.7535000              0.0020710        
  5    202.1895000              0.0081110        
  6     92.0948700              0.0215570        
  7     44.1472000              0.0553160        
  8     21.8546800              0.0802630        
  9     11.0859600              0.1177300        
 10      5.6741080             -0.0650690        
 11      2.8231700             -0.2829140        
 12      1.3686210             -0.6491660        
 13      0.6444310              0.6925670        
 14      0.2483820              0.9789900        
 15      0.0972550             -0.9213570        
P   1
  1      0.0366330              1.0000000        
D   7
  1    100.6630000              0.0035790        
  2     29.8336000              0.0258270        
  3     10.8894000              0.0985590        
  4      4.3935800              0.2383270        
  5      1.8178200              0.3587070        
  6      0.7278270              0.3650920        
  7      0.2712950              0.2337380        
D   7
  1    100.6630000             -0.0034540        
  2     29.8336000             -0.0249250        
  3     10.8894000             -0.0976350        
  4      4.3935800             -0.2366920        
  5      1.8178200             -0.2923500        
  6      0.7278270             -0.0049730        
  7      0.2712950              0.5065880        
D   7
  1    100.6630000              0.0056850        
  2     29.8336000              0.0411710        
  3     10.8894000              0.1693220        
  4      4.3935800              0.3859120        
  5      1.8178200              0.1869090        
  6      0.7278270             -0.6781130        
  7      0.2712950             -0.2582600        
D   1
  1      0.0883090              1.0000000        
F   1
  1      2.7382000              1.0000000        
F   1
  1      0.6543000              1.0000000        
G   1
  1      1.7335000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Fe
data:
IRON
S   19
  1 4316265.0000000             8.048803E-06     
  2 646342.4000000              6.258306E-05     
  3 147089.7000000              0.0003290239     
  4  41661.5200000              0.001387355      
  5  13590.7700000              0.005023256      
  6   4905.7500000              0.0161014        
  7   1912.7460000              0.04590034       
  8    792.6043000              0.1136154        
  9    344.8065000              0.2283869        
 10    155.8999000              0.3221159        
 11     72.2309100              0.2383661        
 12     32.7250600              0.07404667       
 13     15.6676200              0.09214197       
 14      7.5034830              0.0933979        
 15      3.3122230              0.01573965       
 16      1.5584710             -0.0004186682     
 17      0.6839140              5.376318E-05     
 18      0.1467570             -3.816654E-05     
 19      0.0705830              4.319603E-05     
S   19
  1 4316265.0000000            -4.155954E-06     
  2 646342.4000000             -3.231401E-05     
  3 147089.7000000             -0.0001699525     
  4  41661.5200000             -0.0007171369     
  5  13590.7700000             -0.002603625      
  6   4905.7500000             -0.008399109      
  7   1912.7460000             -0.02434109       
  8    792.6043000             -0.06251948       
  9    344.8065000             -0.1365929        
 10    155.8999000             -0.2312707        
 11     72.2309100             -0.2383734        
 12     32.7250600              0.03123837       
 13     15.6676200              0.5086818        
 14      7.5034830              0.4987695        
 15      3.3122230              0.09033552       
 16      1.5584710             -0.006005337      
 17      0.6839140              0.0002312454     
 18      0.1467570             -0.000564368      
 19      0.0705830              0.000499226      
S   19
  1 4316265.0000000             9.532178E-07     
  2 646342.4000000              7.414605E-06     
  3 147089.7000000              3.898393E-05     
  4  41661.5200000              0.0001647152     
  5  13590.7700000              0.000598598      
  6   4905.7500000              0.00194239       
  7   1912.7460000              0.005687237      
  8    792.6043000              0.01501329       
  9    344.8065000              0.03452455       
 10    155.8999000              0.0649582        
 11     72.2309100              0.07716194       
 12     32.7250600             -0.01873411       
 13     15.6676200             -0.3009185        
 14      7.5034830             -0.4554661        
 15      3.3122230              0.1286463        
 16      1.5584710              0.7183316        
 17      0.6839140              0.4051743        
 18      0.1467570              0.02168227       
 19      0.0705830             -0.008343566      
S   19
  1 4316265.0000000            -2.063008E-07     
  2 646342.4000000             -1.604169E-06     
  3 147089.7000000             -8.438437E-06     
  4  41661.5200000             -3.563151E-05     
  5  13590.7700000             -0.0001295998     
  6   4905.7500000             -0.0004201534     
  7   1912.7460000             -0.001231954      
  8    792.6043000             -0.003248922      
  9    344.8065000             -0.007493717      
 10    155.8999000             -0.01410102       
 11     72.2309100             -0.0169160        
 12     32.7250600              0.004218996      
 13     15.6676200              0.0683381        
 14      7.5034830              0.1098201        
 15      3.3122230             -0.04009005       
 16      1.5584710             -0.2174739        
 17      0.6839140             -0.2465135        
 18      0.1467570              0.2731435        
 19      0.0705830              0.5748321        
S   19
  1 4316265.0000000            -4.009367E-07     
  2 646342.4000000             -3.189255E-06     
  3 147089.7000000             -1.623079E-05     
  4  41661.5200000             -7.15792E-05      
  5  13590.7700000             -0.0002463958     
  6   4905.7500000             -0.0008544907     
  7   1912.7460000             -0.002307593      
  8    792.6043000             -0.006728292      
  9    344.8065000             -0.01366165       
 10    155.8999000             -0.0306224        
 11     72.2309100             -0.02631137       
 12     32.7250600             -0.009760183      
 13     15.6676200              0.1801906        
 14      7.5034830              0.1529634        
 15      3.3122230              0.05505413       
 16      1.5584710             -0.9551364        
 17      0.6839140              0.2586813        
 18      0.1467570              1.8340490        
 19      0.0705830             -0.9333240        
S   19
  1 4316265.0000000            -6.966042E-07     
  2 646342.4000000             -5.568036E-06     
  3 147089.7000000             -2.813684E-05     
  4  41661.5200000             -0.0001252418     
  5  13590.7700000             -0.0004260787     
  6   4905.7500000             -0.00149906       
  7   1912.7460000             -0.003979103      
  8    792.6043000             -0.01185686       
  9    344.8065000             -0.02346734       
 10    155.8999000             -0.05467736       
 11     72.2309100             -0.0439382        
 12     32.7250600             -0.02376103       
 13     15.6676200              0.3435928        
 14      7.5034830              0.3192960        
 15      3.3122230             -0.1343207        
 16      1.5584710             -2.2210200        
 17      0.6839140              2.5711420        
 18      0.1467570             -0.2292404        
 19      0.0705830             -1.8324520        
S   1
  1      0.0314490              1.0000000        
P   15
  1  17745.6900000              0.0000410        
  2   4200.7210000              0.0003690        
  3   1364.4290000              0.0021290        
  4    522.0806000              0.0093690        
  5    221.4595000              0.0330970        
  6    100.9096000              0.0944310        
  7     48.4011500              0.2080770        
  8     23.9853600              0.3323330        
  9     12.1825000              0.3329870        
 10      6.2422980              0.1568430        
 11      3.1109440              0.0215490        
 12      1.5099580             -0.0020950        
 13      0.7108450             -0.0017390        
 14      0.2731900             -0.0003000        
 15      0.1042330              0.0000290        
P   15
  1  17745.6900000             -0.0000150        
  2   4200.7210000             -0.0001300        
  3   1364.4290000             -0.0007510        
  4    522.0806000             -0.0033290        
  5    221.4595000             -0.0119120        
  6    100.9096000             -0.0349330        
  7     48.4011500             -0.0799890        
  8     23.9853600             -0.1346360        
  9     12.1825000             -0.1385980        
 10      6.2422980              0.0302780        
 11      3.1109440              0.3332160        
 12      1.5099580              0.4561530        
 13      0.7108450              0.2850510        
 14      0.2731900              0.0461440        
 15      0.1042330             -0.0032490        
P   15
  1  17745.6900000              0.0000030        
  2   4200.7210000              0.0000290        
  3   1364.4290000              0.0001650        
  4    522.0806000              0.0007340        
  5    221.4595000              0.0026260        
  6    100.9096000              0.0077250        
  7     48.4011500              0.0177330        
  8     23.9853600              0.0300550        
  9     12.1825000              0.0310940        
 10      6.2422980             -0.0100480        
 11      3.1109440             -0.0883060        
 12      1.5099580             -0.1298240        
 13      0.7108450             -0.0769370        
 14      0.2731900              0.2126610        
 15      0.1042330              0.5730610        
P   15
  1  17745.6900000              0.0000050        
  2   4200.7210000              0.0000420        
  3   1364.4290000              0.0002410        
  4    522.0806000              0.0010850        
  5    221.4595000              0.0038310        
  6    100.9096000              0.0114230        
  7     48.4011500              0.0257920        
  8     23.9853600              0.0448180        
  9     12.1825000              0.0445980        
 10      6.2422980             -0.0111770        
 11      3.1109440             -0.1381340        
 12      1.5099580             -0.1882850        
 13      0.7108450             -0.1073990        
 14      0.2731900              0.4448630        
 15      0.1042330              0.6402390        
P   15
  1  17745.6900000              0.0000110        
  2   4200.7210000              0.0000870        
  3   1364.4290000              0.0005410        
  4    522.0806000              0.0022260        
  5    221.4595000              0.0085930        
  6    100.9096000              0.0233390        
  7     48.4011500              0.0588440        
  8     23.9853600              0.0882890        
  9     12.1825000              0.1231920        
 10      6.2422980             -0.0631860        
 11      3.1109440             -0.3549020        
 12      1.5099580             -0.6197080        
 13      0.7108450              0.8129860        
 14      0.2731900              0.8191180        
 15      0.1042330             -0.9017050        
P   1
  1      0.0382910              1.0000000        
D   7
  1    113.3440000              0.0035300        
  2     33.6414000              0.0257840        
  3     12.3310000              0.0991190        
  4      4.9947800              0.2390730        
  5      2.0728000              0.3571990        
  6      0.8307530              0.3621880        
  7      0.3091780              0.2364610        
D   7
  1    113.3440000             -0.0038900        
  2     33.6414000             -0.0284420        
  3     12.3310000             -0.1124290        
  4      4.9947800             -0.2742570        
  5      2.0728000             -0.3155460        
  6      0.8307530              0.0571090        
  7      0.3091780              0.5636040        
D   7
  1    113.3440000              0.0056950        
  2     33.6414000              0.0420010        
  3     12.3310000              0.1735400        
  4      4.9947800              0.4101570        
  5      2.0728000              0.1132520        
  6      0.8307530             -0.7696800        
  7      0.3091780             -0.0316430        
D   1
  1      0.1001300              1.0000000        
F   1
  1      3.2758000              1.0000000        
F   1
  1      0.7920000              1.0000000        
G   1
  1      2.0897000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Co
data:
COBALT
S   19
  1 4675675.0000000             7.979026E-06     
  2 700161.5000000              6.204071E-05     
  3 159337.3000000              0.0003261735     
  4  45130.4600000              0.00137536       
  5  14722.3800000              0.004979997      
  6   5314.2220000              0.01596434       
  7   2072.0180000              0.04552086       
  8    858.6188000              0.1127385        
  9    373.5497000              0.2268262        
 10    168.9229000              0.3203074        
 11     78.2963900              0.2374021        
 12     35.5212300              0.07477686       
 13     17.0414400              0.09581872       
 14      8.1730000              0.09649911       
 15      3.6103180              0.01623362       
 16      1.6970470             -0.0004535497     
 17      0.7435320              5.113519E-05     
 18      0.1583440             -4.174508E-05     
 19      0.0750360              4.027577E-05     
S   19
  1 4675675.0000000            -4.20024E-06      
  2 700161.5000000             -3.265831E-05     
  3 159337.3000000             -0.0001717644     
  4  45130.4600000             -0.0007247853     
  5  14722.3800000             -0.002631462      
  6   5314.2220000             -0.008489272      
  7   2072.0180000             -0.02460619       
  8    858.6188000             -0.06322059       
  9    373.5497000             -0.1381957        
 10    168.9229000             -0.2340680        
 11     78.2963900             -0.2415002        
 12     35.5212300              0.03035312       
 13     17.0414400              0.5101341        
 14      8.1730000              0.4974939        
 15      3.6103180              0.08970746       
 16      1.6970470             -0.005941034      
 17      0.7435320              0.0002175362     
 18      0.1583440             -0.0005480155     
 19      0.0750360              0.0004525804     
S   19
  1 4675675.0000000             9.592692E-07     
  2 700161.5000000              7.461851E-06     
  3 159337.3000000              3.923137E-05     
  4  45130.4600000              0.0001657706     
  5  14722.3800000              0.0006024335     
  6   5314.2220000              0.001955217      
  7   2072.0180000              0.005726326      
  8    858.6188000              0.01512984       
  9    373.5497000              0.03483973       
 10    168.9229000              0.06570351       
 11     78.2963900              0.07831503       
 12     35.5212300             -0.01877037       
 13     17.0414400             -0.3062663        
 14      8.1730000             -0.4566429        
 15      3.6103180              0.1378169        
 16      1.6970470              0.7193676        
 17      0.7435320              0.3992579        
 18      0.1583440              0.02079933       
 19      0.0750360             -0.007820663      
S   19
  1 4675675.0000000            -2.02884E-07      
  2 700161.5000000             -1.57758E-06      
  3 159337.3000000             -8.298813E-06     
  4  45130.4600000             -3.504154E-05     
  5  14722.3800000             -0.0001274655     
  6   5314.2220000             -0.0004132695     
  7   2072.0180000             -0.001212261      
  8    858.6188000             -0.003199318      
  9    373.5497000             -0.007390972      
 10    168.9229000             -0.01393649       
 11     78.2963900             -0.01678575       
 12     35.5212300              0.004149856      
 13     17.0414400              0.06797646       
 14      8.1730000              0.1075807        
 15      3.6103180             -0.04166022       
 16      1.6970470             -0.2128044        
 17      0.7435320             -0.2381360        
 18      0.1583440              0.2650788        
 19      0.0750360              0.5722774        
S   19
  1 4675675.0000000            -3.863053E-07     
  2 700161.5000000             -3.068788E-06     
  3 159337.3000000             -1.564826E-05     
  4  45130.4600000             -6.883588E-05     
  5  14722.3800000             -0.0002377367     
  6   5314.2220000             -0.0008213173     
  7   2072.0180000             -0.00222963       
  8    858.6188000             -0.006467841      
  9    373.5497000             -0.01325463       
 10    168.9229000             -0.02946686       
 11     78.2963900             -0.02599066       
 12     35.5212300             -0.008499807      
 13     17.0414400              0.1727316        
 14      8.1730000              0.1512189        
 15      3.6103180              0.03554509       
 16      1.6970470             -0.8829353        
 17      0.7435320              0.2143530        
 18      0.1583440              1.7118650        
 19      0.0750360             -0.7140037        
S   19
  1 4675675.0000000            -7.174687E-07     
  2 700161.5000000             -5.722157E-06     
  3 159337.3000000             -2.90097E-05      
  4  45130.4600000             -0.0001285845     
  5  14722.3800000             -0.0004398434     
  6   5314.2220000             -0.001537586      
  7   2072.0180000             -0.004116022      
  8    858.6188000             -0.01215514       
  9    373.5497000             -0.02440441       
 10    168.9229000             -0.05601976       
 11     78.2963900             -0.04689449       
 12     35.5212300             -0.02168828       
 13     17.0414400              0.3477789        
 14      8.1730000              0.3500597        
 15      3.6103180             -0.2048551        
 16      1.6970470             -2.1632110        
 17      0.7435320              2.5240910        
 18      0.1583440             -0.1590011        
 19      0.0750360             -1.8252670        
S   1
  1      0.0330910              1.0000000        
P   15
  1  19267.7800000              0.0000410        
  2   4560.9860000              0.0003690        
  3   1481.4360000              0.0021280        
  4    566.8671000              0.0093720        
  5    240.4910000              0.0331550        
  6    109.6105000              0.0947520        
  7     52.5949100              0.2090930        
  8     26.0836100              0.3337220        
  9     13.2614300              0.3322080        
 10      6.7997780              0.1546130        
 11      3.3934140              0.0209020        
 12      1.6487660             -0.0020240        
 13      0.7762820             -0.0016970        
 14      0.2980030             -0.0002800        
 15      0.1136180              0.0000260        
P   15
  1  19267.7800000             -0.0000150        
  2   4560.9860000             -0.0001310        
  3   1481.4360000             -0.0007580        
  4    566.8671000             -0.0033630        
  5    240.4910000             -0.0120540        
  6    109.6105000             -0.0354240        
  7     52.5949100             -0.0812870        
  8     26.0836100             -0.1369080        
  9     13.2614300             -0.1390190        
 10      6.7997780              0.0354680        
 11      3.3934140              0.3384980        
 12      1.6487660              0.4544330        
 13      0.7762820              0.2797930        
 14      0.2980030              0.0447760        
 15      0.1136180             -0.0031510        
P   15
  1  19267.7800000             -0.0000030        
  2   4560.9860000             -0.0000290        
  3   1481.4360000             -0.0001670        
  4    566.8671000             -0.0007420        
  5    240.4910000             -0.0026620        
  6    109.6105000             -0.0078410        
  7     52.5949100             -0.0180510        
  8     26.0836100             -0.0305800        
  9     13.2614300             -0.0313120        
 10      6.7997780              0.0113110        
 11      3.3934140              0.0899900        
 12      1.6487660              0.1307330        
 13      0.7762820              0.0718080        
 14      0.2980030             -0.2216580        
 15      0.1136180             -0.5710250        
P   15
  1  19267.7800000              0.0000050        
  2   4560.9860000              0.0000450        
  3   1481.4360000              0.0002550        
  4    566.8671000              0.0011440        
  5    240.4910000              0.0040610        
  6    109.6105000              0.0120950        
  7     52.5949100              0.0274760        
  8     26.0836100              0.0475570        
  9     13.2614300              0.0473020        
 10      6.7997780             -0.0144180        
 11      3.3934140             -0.1500620        
 12      1.6487660             -0.1990920        
 13      0.7762820             -0.0797830        
 14      0.2980030              0.4590350        
 15      0.1136180              0.6174950        
P   15
  1  19267.7800000              0.0000110        
  2   4560.9860000              0.0000920        
  3   1481.4360000              0.0005630        
  4    566.8671000              0.0023540        
  5    240.4910000              0.0089760        
  6    109.6105000              0.0248100        
  7     52.5949100              0.0615800        
  8     26.0836100              0.0947770        
  9     13.2614300              0.1266930        
 10      6.7997780             -0.0637540        
 11      3.3934140             -0.4185660        
 12      1.6487660             -0.5678650        
 13      0.7762820              0.8754060        
 14      0.2980030              0.7182630        
 15      0.1136180             -0.8747220        
P   1
  1      0.0416240              1.0000000        
D   7
  1    126.2640000              0.0035100        
  2     37.5226000              0.0258840        
  3     13.8021000              0.1000580        
  4      5.6092700              0.2405470        
  5      2.3336900              0.3568430        
  6      0.9364150              0.3595790        
  7      0.3482370              0.2366290        
D   7
  1    126.2640000             -0.0040670        
  2     37.5226000             -0.0300530        
  3     13.8021000             -0.1196200        
  4      5.6092700             -0.2915130        
  5      2.3336900             -0.3180480        
  6      0.9364150              0.0916980        
  7      0.3482370              0.5608230        
D   7
  1    126.2640000              0.0054700        
  2     37.5226000              0.0408130        
  3     13.8021000              0.1689780        
  4      5.6092700              0.4093590        
  5      2.3336900              0.0863160        
  6      0.9364150             -0.7690080        
  7      0.3482370              0.0033550        
D   1
  1      0.1123530              1.0000000        
F   1
  1      3.8137000              1.0000000        
F   1
  1      0.9309000              1.0000000        
G   1
  1      2.4709000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ni
data:
NICKEL
S   19
  1 5045991.0000000             8.208996E-06     
  2 755614.2000000              6.382884E-05     
  3 171956.8000000              0.00033558       
  4  48704.7900000              0.001415075      
  5  15888.4100000              0.005124444      
  6   5735.1230000              0.01643256       
  7   2236.1370000              0.04689398       
  8    926.6468000              0.1163534        
  9    403.1743000              0.2350511        
 10    182.3476000              0.3350184        
 11     84.5488500              0.2534779        
 12     38.3963400              0.07300901       
 13     18.4585900              0.06184244       
 14      8.8635480              0.06302956       
 15      3.9162270              0.01008063       
 16      1.8388700             -0.0002244528     
 17      0.8043620             -5.932767E-05     
 18      0.1697970             -1.158562E-05     
 19      0.0793060              8.115109E-06     
S   19
  1 5045991.0000000            -3.657849E-06     
  2 755614.2000000             -2.844094E-05     
  3 171956.8000000             -0.0001495928     
  4  48704.7900000             -0.0006313009     
  5  15888.4100000             -0.002293052      
  6   5735.1230000             -0.007405123      
  7   2236.1370000             -0.02152032       
  8    926.6468000             -0.05560974       
  9    403.1743000             -0.1230176        
 10    182.3476000             -0.2130104        
 11     84.5488500             -0.2265837        
 12     38.3963400              0.03546796       
 13     18.4585900              0.5181697        
 14      8.8635480              0.5025630        
 15      3.9162270              0.08955674       
 16      1.8388700             -0.007031311      
 17      0.8043620             -0.0004339167     
 18      0.1697970             -0.0005831711     
 19      0.0793060              0.0004228788     
S   19
  1 5045991.0000000             9.594149E-07     
  2 755614.2000000              7.462614E-06     
  3 171956.8000000              3.923843E-05     
  4  48704.7900000              0.0001657868     
  5  15888.4100000              0.0006025905     
  6   5735.1230000              0.001955662      
  7   2236.1370000              0.005730391      
  8    926.6468000              0.01514756       
  9    403.1743000              0.03493499       
 10    182.3476000              0.06598072       
 11     84.5488500              0.07893083       
 12     38.3963400             -0.01906249       
 13     18.4585900             -0.3095921        
 14      8.8635480             -0.4558610        
 15      3.9162270              0.1482931        
 16      1.8388700              0.7134039        
 17      0.8043620              0.3976063        
 18      0.1697970              0.02295523       
 19      0.0793060             -0.009151758      
S   19
  1 5045991.0000000            -2.013753E-07     
  2 755614.2000000             -1.565832E-06     
  3 171956.8000000             -8.237182E-06     
  4  48704.7900000             -3.478105E-05     
  5  15888.4100000             -0.0001265265     
  6   5735.1230000             -0.0004102589     
  7   2236.1370000             -0.001203834      
  8    926.6468000             -0.003179062      
  9    403.1743000             -0.007353828      
 10    182.3476000             -0.01389022       
 11     84.5488500             -0.01677875       
 12     38.3963400              0.004163378      
 13     18.4585900              0.06814703       
 14      8.8635480              0.1061029        
 15      3.9162270             -0.0433998        
 16      1.8388700             -0.2094950        
 17      0.8043620             -0.2310271        
 18      0.1697970              0.2590532        
 19      0.0793060              0.5691426        
S   19
  1 5045991.0000000            -3.924245E-07     
  2 755614.2000000             -3.113909E-06     
  3 171956.8000000             -1.590447E-05     
  4  48704.7900000             -6.981394E-05     
  5  15888.4100000             -0.0002417848     
  6   5735.1230000             -0.0008326195     
  7   2236.1370000             -0.002270294      
  8    926.6468000             -0.006557427      
  9    403.1743000             -0.01354288       
 10    182.3476000             -0.02989768       
 11     84.5488500             -0.02693106       
 12     38.3963400             -0.007827693      
 13     18.4585900              0.1741667        
 14      8.8635480              0.1595468        
 15      3.9162270              0.0199555        
 16      1.8388700             -0.8897000        
 17      0.8043620              0.2486892        
 18      0.1697970              1.6130120        
 19      0.0793060             -0.5990277        
S   19
  1 5045991.0000000            -7.303633E-07     
  2 755614.2000000             -5.802013E-06     
  3 171956.8000000             -2.958547E-05     
  4  48704.7900000             -0.0001301499     
  5  15888.4100000             -0.0004495332     
  6   5735.1230000             -0.001553314      
  7   2236.1370000             -0.004219884      
  8    926.6468000             -0.01225419       
  9    403.1743000             -0.02519707       
 10    182.3476000             -0.05621717       
 11     84.5488500             -0.05022229       
 12     38.3963400             -0.01677412       
 13     18.4585900              0.3388021        
 14      8.8635480              0.3984975        
 15      3.9162270             -0.3032053        
 16      1.8388700             -2.0796190        
 17      0.8043620              2.5005420        
 18      0.1697970             -0.2169002        
 19      0.0793060             -1.7091780        
S   1
  1      0.0346770              1.0000000        
P   15
  1  21027.9200000              0.0000410        
  2   4977.5600000              0.0003630        
  3   1616.7400000              0.0020970        
  4    618.6718000              0.0092500        
  5    262.5183000              0.0327960        
  6    119.6907000              0.0940040        
  7     57.4658500              0.2082800        
  8     28.5282900              0.3336540        
  9     14.5214800              0.3329040        
 10      7.4538500              0.1553720        
 11      3.7235530              0.0208590        
 12      1.8098130             -0.0024400        
 13      0.8513360             -0.0019980        
 14      0.3248140             -0.0003380        
 15      0.1195220              0.0000350        
P   15
  1  21027.9200000             -0.0000150        
  2   4977.5600000             -0.0001290        
  3   1616.7400000             -0.0007490        
  4    618.6718000             -0.0033280        
  5    262.5183000             -0.0119470        
  6    119.6907000             -0.0352420        
  7     57.4658500             -0.0812040        
  8     28.5282900             -0.1374930        
  9     14.5214800             -0.1392260        
 10      7.4538500              0.0360160        
 11      3.7235530              0.3391280        
 12      1.8098130              0.4504720        
 13      0.8513360              0.2817830        
 14      0.3248140              0.0478980        
 15      0.1195220             -0.0029870        
P   15
  1  21027.9200000              0.0000030        
  2   4977.5600000              0.0000260        
  3   1616.7400000              0.0001520        
  4    618.6718000              0.0006780        
  5    262.5183000              0.0024270        
  6    119.6907000              0.0072010        
  7     57.4658500              0.0165780        
  8     28.5282900              0.0283920        
  9     14.5214800              0.0285990        
 10      7.4538500             -0.0101320        
 11      3.7235530             -0.0829120        
 12      1.8098130             -0.1159980        
 13      0.8513360             -0.0727950        
 14      0.3248140              0.1956400        
 15      0.1195220              0.5670990        
P   15
  1  21027.9200000              0.0000060        
  2   4977.5600000              0.0000530        
  3   1616.7400000              0.0003050        
  4    618.6718000              0.0013640        
  5    262.5183000              0.0048760        
  6    119.6907000              0.0145030        
  7     57.4658500              0.0332960        
  8     28.5282900              0.0574820        
  9     14.5214800              0.0587020        
 10      7.4538500             -0.0199040        
 11      3.7235530             -0.1946950        
 12      1.8098130             -0.2396130        
 13      0.8513360             -0.0022320        
 14      0.3248140              0.5214350        
 15      0.1195220              0.5455400        
P   15
  1  21027.9200000              0.0000110        
  2   4977.5600000              0.0000950        
  3   1616.7400000              0.0005800        
  4    618.6718000              0.0024510        
  5    262.5183000              0.0092820        
  6    119.6907000              0.0260090        
  7     57.4658500              0.0640960        
  8     28.5282900              0.1007100        
  9     14.5214800              0.1325390        
 10      7.4538500             -0.0650890        
 11      3.7235530             -0.4897560        
 12      1.8098130             -0.4984550        
 13      0.8513360              0.9663570        
 14      0.3248140              0.5283790        
 15      0.1195220             -0.8676760        
P   1
  1      0.0423660              1.0000000        
D   7
  1    140.2527000              0.0033760        
  2     41.7261000              0.0251410        
  3     15.3981000              0.0977460        
  4      6.2771000              0.2347090        
  5      2.6185000              0.3469450        
  6      1.0526000              0.3510680        
  7      0.3916000              0.2502550        
D   7
  1    140.2527000             -0.0034950        
  2     41.7261000             -0.0260150        
  3     15.3981000             -0.1038760        
  4      6.2771000             -0.2520700        
  5      2.6185000             -0.2945800        
  6      1.0526000              0.0011520        
  7      0.3916000              0.4385890        
D   7
  1    140.2527000              0.0050520        
  2     41.7261000              0.0380870        
  3     15.3981000              0.1561130        
  4      6.2771000              0.3861560        
  5      2.6185000              0.1756050        
  6      1.0526000             -0.6268070        
  7      0.3916000             -0.3427750        
D   1
  1      0.1262000              1.0000000        
F   1
  1      4.5046000              1.0000000        
F   1
  1      1.1286000              1.0000000        
G   1
  1      2.9771000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Cu
data:
COPPER
S   19
  1 5430321.0000000             7.801026E-06     
  2 813166.5000000              6.065666E-05     
  3 185054.4000000              0.0003188964     
  4  52414.6600000              0.001344687      
  5  17098.6800000              0.00486905       
  6   6171.9940000              0.01561013       
  7   2406.4810000              0.04452077       
  8    997.2584000              0.1103111        
  9    433.9289000              0.2220342        
 10    196.2869000              0.3133739        
 11     91.0428000              0.2315121        
 12     41.3842500              0.0764092        
 13     19.9327800              0.1103818        
 14      9.5818910              0.1094372        
 15      4.2345160              0.01836311       
 16      1.9858140             -0.0006043084     
 17      0.8670830              5.092245E-05     
 18      0.1813390             -5.54073E-05      
 19      0.0836570              3.969482E-05     
S   19
  1 5430321.0000000            -4.404706E-06     
  2 813166.5000000             -3.424801E-05     
  3 185054.4000000             -0.0001801238     
  4  52414.6600000             -0.0007600455     
  5  17098.6800000             -0.002759348      
  6   6171.9940000             -0.00890097       
  7   2406.4810000             -0.02579378       
  8    997.2584000             -0.06623861       
  9    433.9289000             -0.1445927        
 10    196.2869000             -0.2440110        
 11     91.0428000             -0.2504837        
 12     41.3842500              0.02852577       
 13     19.9327800              0.5115874        
 14      9.5818910              0.4928061        
 15      4.2345160              0.08788437       
 16      1.9858140             -0.005820281      
 17      0.8670830              0.0002013508     
 18      0.1813390             -0.0005182553     
 19      0.0836570              0.0003731503     
S   19
  1 5430321.0000000             9.704682E-07     
  2 813166.5000000              7.549245E-06     
  3 185054.4000000              3.968892E-05     
  4  52414.6600000              0.00016772       
  5  17098.6800000              0.0006095101     
  6   6171.9940000              0.001978846      
  7   2406.4810000              0.005798049      
  8    997.2584000              0.01534158       
  9    433.9289000              0.03540484       
 10    196.2869000              0.06702098       
 11     91.0428000              0.08026945       
 12     41.3842500             -0.01927231       
 13     19.9327800             -0.3160129        
 14      9.5818910             -0.4573162        
 15      4.2345160              0.1550841        
 16      1.9858140              0.7202872        
 17      0.8670830              0.3885122        
 18      0.1813390              0.01924326       
 19      0.0836570             -0.007103807      
S   19
  1 5430321.0000000            -1.959354E-07     
  2 813166.5000000             -1.523472E-06     
  3 185054.4000000             -8.014808E-06     
  4  52414.6600000             -3.383992E-05     
  5  17098.6800000             -0.0001231191     
  6   6171.9940000             -0.0003992085     
  7   2406.4810000             -0.0011719        
  8    997.2584000             -0.003096141      
  9    433.9289000             -0.007171993      
 10    196.2869000             -0.01356621       
 11     91.0428000             -0.01643989       
 12     41.3842500              0.004107628      
 13     19.9327800              0.06693964       
 14      9.5818910              0.1028221        
 15      4.2345160             -0.04422945       
 16      1.9858140             -0.2031191        
 17      0.8670830             -0.2230022        
 18      0.1813390              0.2517975        
 19      0.0836570              0.5650091        
S   19
  1 5430321.0000000            -3.532229E-07     
  2 813166.5000000             -2.798812E-06     
  3 185054.4000000             -1.432517E-05     
  4  52414.6600000             -6.270946E-05     
  5  17098.6800000             -0.000217949      
  6   6171.9940000             -0.0007474316     
  7   2406.4810000             -0.002049271      
  8    997.2584000             -0.005885203      
  9    433.9289000             -0.01226885       
 10    196.2869000             -0.02683147       
 11     91.0428000             -0.02479261       
 12     41.3842500             -0.005984746      
 13     19.9327800              0.1557124        
 14      9.5818910              0.1436683        
 15      4.2345160              0.008374103      
 16      1.9858140             -0.7460711        
 17      0.8670830              0.1244367        
 18      0.1813390              1.5101100        
 19      0.0836570             -0.3477122        
S   19
  1 5430321.0000000            -7.508267E-07     
  2 813166.5000000             -5.972018E-06     
  3 185054.4000000             -3.039682E-05     
  4  52414.6600000             -0.0001340405     
  5  17098.6800000             -0.0004615778     
  6   6171.9940000             -0.001601064      
  7   2406.4810000             -0.004330942      
  8    997.2584000             -0.01265434       
  9    433.9289000             -0.02586864       
 10    196.2869000             -0.05835428       
 11     91.0428000             -0.05132322       
 12     41.3842500             -0.01908953       
 13     19.9327800              0.3586116        
 14      9.5818910              0.3885818        
 15      4.2345160             -0.3057106        
 16      1.9858140             -2.0698960        
 17      0.8670830              2.4317740        
 18      0.1813390             -0.02121974       
 19      0.0836570             -1.8202510        
S   1
  1      0.0362670              1.0000000        
P   15
  1  22760.5700000              0.0000400        
  2   5387.6790000              0.0003610        
  3   1749.9450000              0.0020830        
  4    669.6653000              0.0091970        
  5    284.1948000              0.0326600        
  6    129.6077000              0.0937950        
  7     62.2541500              0.2082740        
  8     30.9296400              0.3339930        
  9     15.7582700              0.3324930        
 10      8.0942110              0.1547280        
 11      4.0469210              0.0212710        
 12      1.9678690             -0.0016900        
 13      0.9252950             -0.0015160        
 14      0.3529920             -0.0002420        
 15      0.1273070              0.0000230        
P   15
  1  22760.5700000             -0.0000150        
  2   5387.6790000             -0.0001310        
  3   1749.9450000             -0.0007550        
  4    669.6653000             -0.0033590        
  5    284.1948000             -0.0120810        
  6    129.6077000             -0.0357030        
  7     62.2541500             -0.0825020        
  8     30.9296400             -0.1398900        
  9     15.7582700             -0.1407290        
 10      8.0942110              0.0387660        
 11      4.0469210              0.3426950        
 12      1.9678690              0.4523100        
 13      0.9252950              0.2770540        
 14      0.3529920              0.0438850        
 15      0.1273070             -0.0028020        
P   15
  1  22760.5700000              0.0000030        
  2   5387.6790000              0.0000250        
  3   1749.9450000              0.0001470        
  4    669.6653000              0.0006560        
  5    284.1948000              0.0023510        
  6    129.6077000              0.0070040        
  7     62.2541500              0.0161310        
  8     30.9296400              0.0277700        
  9     15.7582700              0.0275670        
 10      8.0942110             -0.0101150        
 11      4.0469210             -0.0810090        
 12      1.9678690             -0.1104090        
 13      0.9252950             -0.0717320        
 14      0.3529920              0.1879300        
 15      0.1273070              0.5646290        
P   15
  1  22760.5700000              0.0000050        
  2   5387.6790000              0.0000490        
  3   1749.9450000              0.0002780        
  4    669.6653000              0.0012530        
  5    284.1948000              0.0044470        
  6    129.6077000              0.0133700        
  7     62.2541500              0.0304690        
  8     30.9296400              0.0534470        
  9     15.7582700              0.0526390        
 10      8.0942110             -0.0168810        
 11      4.0469210             -0.1794480        
 12      1.9678690             -0.2095880        
 13      0.9252950             -0.0396330        
 14      0.3529920              0.5021300        
 15      0.1273070              0.5811110        
P   15
  1  22760.5700000              0.0000110        
  2   5387.6790000              0.0000960        
  3   1749.9450000              0.0005900        
  4    669.6653000              0.0024840        
  5    284.1948000              0.0094630        
  6    129.6077000              0.0264530        
  7     62.2541500              0.0656890        
  8     30.9296400              0.1027320        
  9     15.7582700              0.1370410        
 10      8.0942110             -0.0709610        
 11      4.0469210             -0.5047080        
 12      1.9678690             -0.4780560        
 13      0.9252950              0.9428920        
 14      0.3529920              0.5446990        
 15      0.1273070             -0.8327660        
P   1
  1      0.0443560              1.0000000        
D   7
  1    173.8970000              0.0027000        
  2     51.8869000              0.0209090        
  3     19.3419000              0.0844080        
  4      7.9757200              0.2139990        
  5      3.3982300              0.3359800        
  6      1.4093200              0.3573010        
  7      0.5488580              0.2645780        
D   7
  1    173.8970000             -0.0033630        
  2     51.8869000             -0.0260790        
  3     19.3419000             -0.1082310        
  4      7.9757200             -0.2822170        
  5      3.3982300             -0.3471900        
  6      1.4093200              0.0267110        
  7      0.5488580              0.4920470        
D   7
  1    173.8970000              0.0041330        
  2     51.8869000              0.0330850        
  3     19.3419000              0.1383360        
  4      7.9757200              0.3901660        
  5      3.3982300              0.1698420        
  6      1.4093200             -0.6830180        
  7      0.5488580             -0.2657970        
D   1
  1      0.1901990              1.0000000        
F   1
  1      5.0821000              1.0000000        
F   1
  1      1.2797000              1.0000000        
G   1
  1      3.4835000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Zn
data:
ZINC
S   19
  1 5820021.0000000             8.549241E-06     
  2 871523.4000000              6.64741E-05      
  3 198335.0000000              0.0003494962     
  4  56176.3100000              0.001473832      
  5  18325.8200000              0.00533833       
  6   6614.9550000              0.01712708       
  7   2579.1990000              0.04894085       
  8   1068.8490000              0.1217934        
  9    465.1045000              0.2476589        
 10    210.4130000              0.3582431        
 11     97.6162900              0.2798174        
 12     44.3802000              0.06857491       
 13     21.4230800             -0.001311092      
 14     10.3089100              0.001914001      
 15      4.5536450             -0.000875922      
 16      2.1328210              0.0003740096     
 17      0.9296970             -0.0001401399     
 18      0.1921470              4.757132E-05     
 19      0.0875950             -3.642711E-05     
S   19
  1 5820021.0000000            -2.640069E-06     
  2 871523.4000000             -2.05272E-05      
  3 198335.0000000             -0.0001079859     
  4  56176.3100000             -0.0004558577     
  5  18325.8200000             -0.001657758      
  6   6614.9550000             -0.005368492      
  7   2579.1990000             -0.01571249       
  8   1068.8490000             -0.04122558       
  9    465.1045000             -0.09406459       
 10    210.4130000             -0.1719954        
 11     97.6162900             -0.1958523        
 12     44.3802000              0.04532907       
 13     21.4230800              0.5244442        
 14     10.3089100              0.5006142        
 15      4.5536450              0.08945527       
 16      2.1328210             -0.002146262      
 17      0.9296970              0.002112113      
 18      0.1921470             -0.000413398      
 19      0.0875950              0.0003209752     
S   19
  1 5820021.0000000             9.967103E-07     
  2 871523.4000000              7.754163E-06     
  3 198335.0000000              4.076019E-05     
  4  56176.3100000              0.0001722811     
  5  18325.8200000              0.000625937      
  6   6614.9550000              0.002032855      
  7   2579.1990000              0.005954646      
  8   1068.8490000              0.0157664        
  9    465.1045000              0.03637638       
 10    210.4130000              0.06892343       
 11     97.6162900              0.08238093       
 12     44.3802000             -0.0201136        
 13     21.4230800             -0.3252526        
 14     10.3089100             -0.4602899        
 15      4.5536450              0.1635546        
 16      2.1328210              0.7297118        
 17      0.9296970              0.3769751        
 18      0.1921470              0.01433224       
 19      0.0875950             -0.00667121       
S   19
  1 5820021.0000000             1.995818E-07     
  2 871523.4000000              1.552973E-06     
  3 198335.0000000              8.161259E-06     
  4  56176.3100000              3.450747E-05     
  5  18325.8200000              0.0001253275     
  6   6614.9550000              0.000407299      
  7   2579.1990000              0.001192734      
  8   1068.8490000              0.00316314       
  9    465.1045000              0.007303942      
 10    210.4130000              0.01391279       
 11     97.6162900              0.0167062        
 12     44.3802000             -0.004035586      
 13     21.4230800             -0.06968861       
 14     10.3089100             -0.1030105        
 15      4.5536450              0.04471442       
 16      2.1328210              0.2150027        
 17      0.9296970              0.2220163        
 18      0.1921470             -0.3114776        
 19      0.0875950             -0.5693429        
S   19
  1 5820021.0000000            -5.43591E-07      
  2 871523.4000000             -4.336894E-06     
  3 198335.0000000             -2.197572E-05     
  4  56176.3100000             -9.747392E-05     
  5  18325.8200000             -0.0003331615     
  6   6614.9550000             -0.001166192      
  7   2579.1990000             -0.003119308      
  8   1068.8490000             -0.009239504      
  9    465.1045000             -0.01855471       
 10    210.4130000             -0.04281189       
 11     97.6162900             -0.03571095       
 12     44.3802000             -0.0163835        
 13     21.4230800              0.2644664        
 14     10.3089100              0.2086588        
 15      4.5536450             -0.01774382       
 16      2.1328210             -1.3538730        
 17      0.9296970              0.8182926        
 18      0.1921470              1.6950360        
 19      0.0875950             -1.3886560        
S   19
  1 5820021.0000000             8.040791E-07     
  2 871523.4000000              6.282936E-06     
  3 198335.0000000              3.281868E-05     
  4  56176.3100000              0.0001398858     
  5  18325.8200000              0.0005029836     
  6   6614.9550000              0.001655419      
  7   2579.1990000              0.004778677      
  8   1068.8490000              0.01292479       
  9    465.1045000              0.02925831       
 10    210.4130000              0.05791816       
 11     97.6162900              0.06640681       
 12     44.3802000             -0.007388966      
 13     21.4230800             -0.3329989        
 14     10.3089100             -0.5917865        
 15      4.5536450              0.9011406        
 16      2.1328210              1.5859510        
 17      0.9296970             -2.7880080        
 18      0.1921470              2.0718840        
 19      0.0875950             -0.6012025        
S   1
  1      0.0377020              1.0000000        
P   15
  1  24411.9800000              0.0000410        
  2   5778.5180000              0.0003610        
  3   1876.8620000              0.0020880        
  4    718.2361000              0.0092210        
  5    304.8327000              0.0327730        
  6    139.0453000              0.0941790        
  7     66.8041700              0.2091320        
  8     33.2069900              0.3345690        
  9     16.9281600              0.3303590        
 10      8.6962290              0.1523470        
 11      4.3505100              0.0229840        
 12      2.1165230              0.0016070        
 13      0.9953870              0.0004680        
 14      0.3781120              0.0000660        
 15      0.1345790             -0.0000020        
P   15
  1  24411.9800000             -0.0000150        
  2   5778.5180000             -0.0001350        
  3   1876.8620000             -0.0007820        
  4    718.2361000             -0.0034780        
  5    304.8327000             -0.0125200        
  6    139.0453000             -0.0370160        
  7     66.8041700             -0.0855590        
  8     33.2069900             -0.1447180        
  9     16.9281600             -0.1434420        
 10      8.6962290              0.0435950        
 11      4.3505100              0.3488880        
 12      2.1165230              0.4538650        
 13      0.9953870              0.2685940        
 14      0.3781120              0.0388680        
 15      0.1345790             -0.0024920        
P   15
  1  24411.9800000              0.0000030        
  2   5778.5180000              0.0000250        
  3   1876.8620000              0.0001440        
  4    718.2361000              0.0006450        
  5    304.8327000              0.0023110        
  6    139.0453000              0.0068980        
  7     66.8041700              0.0158820        
  8     33.2069900              0.0273500        
  9     16.9281600              0.0266210        
 10      8.6962290             -0.0108580        
 11      4.3505100             -0.0798530        
 12      2.1165230             -0.1061270        
 13      0.9953870             -0.0688830        
 14      0.3781120              0.1843850        
 15      0.1345790              0.5617880        
P   15
  1  24411.9800000              0.0000050        
  2   5778.5180000              0.0000420        
  3   1876.8620000              0.0002380        
  4    718.2361000              0.0010880        
  5    304.8327000              0.0038210        
  6    139.0453000              0.0116440        
  7     66.8041700              0.0261670        
  8     33.2069900              0.0467500        
  9     16.9281600              0.0433090        
 10      8.6962290             -0.0134290        
 11      4.3505100             -0.1538970        
 12      2.1165230             -0.1674130        
 13      0.9953870             -0.0849950        
 14      0.3781120              0.4508130        
 15      0.1345790              0.6408690        
P   15
  1  24411.9800000              0.0000120        
  2   5778.5180000              0.0000960        
  3   1876.8620000              0.0005940        
  4    718.2361000              0.0024840        
  5    304.8327000              0.0095370        
  6    139.0453000              0.0264790        
  7     66.8041700              0.0663660        
  8     33.2069900              0.1024580        
  9     16.9281600              0.1386830        
 10      8.6962290             -0.0801400        
 11      4.3505100             -0.4960690        
 12      2.1165230             -0.4635100        
 13      0.9953870              0.8745310        
 14      0.3781120              0.6297900        
 15      0.1345790             -0.8116860        
P   1
  1      0.0462820              1.0000000        
D   7
  1    205.6177000              0.0023420        
  2     61.4498100              0.0186060        
  3     23.0568900              0.0771020        
  4      9.5777390              0.2020260        
  5      4.1337340              0.3294540        
  6      1.7475180              0.3609760        
  7      0.6995600              0.2716570        
D   7
  1    205.6177000              0.0032790        
  2     61.4498100              0.0261760        
  3     23.0568900              0.1113670        
  4      9.5777390              0.3045810        
  5      4.1337340              0.3862990        
  6      1.7475180             -0.0583750        
  7      0.6995600             -0.5388760        
D   7
  1    205.6177000              0.0037400        
  2     61.4498100              0.0318250        
  3     23.0568900              0.1322290        
  4      9.5777390              0.4245500        
  5      4.1337340              0.1203700        
  6      1.7475180             -0.7626610        
  7      0.6995600             -0.1128230        
D   1
  1      0.2516080              1.0000000        
F   1
  1      5.7922000              1.0000000        
F   1
  1      1.4851000              1.0000000        
G   1
  1      4.1144000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ga
data:
GALLIUM
S   18
  1 6558157.3000000             0.0000080        
  2 982025.3400000              0.0000622        
  3 223467.6900000              0.0003270        
  4  63288.2910000              0.0013794        
  5  20642.9400000              0.0049993        
  6   7450.5224000              0.0160605        
  7   2905.0744000              0.0460124        
  8   1204.2100000              0.1152224        
  9    524.3045400              0.2373921        
 10    237.4656300              0.3531989        
 11    110.5786600              0.2915500        
 12     51.3746240              0.0812129        
 13     24.4408460              0.0007655        
 14     11.7685910              0.0016124        
 15      5.3421190             -0.0007530        
 16      2.4950360              0.0003134        
 17      1.0987730             -0.0001306        
 18      0.2601800              0.0000513        
S   18
  1 6558157.3000000            -0.0000025        
  2 982025.3400000             -0.0000193        
  3 223467.6900000             -0.0001014        
  4  63288.2910000             -0.0004281        
  5  20642.9400000             -0.0015582        
  6   7450.5224000             -0.0050469        
  7   2905.0744000             -0.0148056        
  8   1204.2100000             -0.0389482        
  9    524.3045400             -0.0896832        
 10    237.4656300             -0.1664076        
 11    110.5786600             -0.2004010        
 12     51.3746240              0.0114943        
 13     24.4408460              0.4958134        
 14     11.7685910              0.5295550        
 15      5.3421190              0.1110185        
 16      2.4950360             -0.0007000        
 17      1.0987730              0.0022283        
 18      0.2601800             -0.0005014        
S   18
  1 6558157.3000000             0.0000009        
  2 982025.3400000              0.0000074        
  3 223467.6900000              0.0000387        
  4  63288.2910000              0.0001633        
  5  20642.9400000              0.0005944        
  6   7450.5224000              0.0019292        
  7   2905.0744000              0.0056689        
  8   1204.2100000              0.0150282        
  9    524.3045400              0.0350222        
 10    237.4656300              0.0671135        
 11    110.5786600              0.0850156        
 12     51.3746240             -0.0047212        
 13     24.4408460             -0.3016737        
 14     11.7685910             -0.4825489        
 15      5.3421190              0.0891695        
 16      2.4950360              0.7287830        
 17      1.0987730              0.4288542        
 18      0.2601800              0.0207249        
S   18
  1 6558157.3000000             0.0000002        
  2 982025.3400000              0.0000017        
  3 223467.6900000              0.0000090        
  4  63288.2910000              0.0000380        
  5  20642.9400000              0.0001382        
  6   7450.5224000              0.0004489        
  7   2905.0744000              0.0013188        
  8   1204.2100000              0.0035016        
  9    524.3045400              0.0081673        
 10    237.4656300              0.0157338        
 11    110.5786600              0.0200284        
 12     51.3746240             -0.0010136        
 13     24.4408460             -0.0750162        
 14     11.7685910             -0.1257980        
 15      5.3421190              0.0300857        
 16      2.4950360              0.2488169        
 17      1.0987730              0.2843706        
 18      0.2601800             -0.3110594        
S   1
  1      0.1270790              1.0000000        
S   1
  1      0.0544080              1.0000000        
P   11
  1   8050.1674000              0.0003169        
  2   1907.5361000              0.0027648        
  3    618.6274600              0.0151204        
  4    235.3241700              0.0599583        
  5     98.8996460              0.1733120        
  6     44.2482150              0.3410820        
  7     20.6174290              0.3896967        
  8      9.7805160              0.1839817        
  9      4.4412380              0.0218896        
 10      1.9640450              0.0011608        
 11      0.8335780              0.0002735        
P   11
  1   8050.1674000             -0.0001203        
  2   1907.5361000             -0.0010492        
  3    618.6274600             -0.0058102        
  4    235.3241700             -0.0234345        
  5     98.8996460             -0.0708270        
  6     44.2482150             -0.1465511        
  7     20.6174290             -0.1769660        
  8      9.7805160              0.0363821        
  9      4.4412380              0.4232848        
 10      1.9640450              0.4952586        
 11      0.8335780              0.1797428        
P   11
  1   8050.1674000              0.0000200        
  2   1907.5361000              0.0001689        
  3    618.6274600              0.0009668        
  4    235.3241700              0.0037797        
  5     98.8996460              0.0119082        
  6     44.2482150              0.0235693        
  7     20.6174290              0.0314233        
  8      9.7805160             -0.0136188        
  9      4.4412380             -0.0734003        
 10      1.9640450             -0.1264785        
 11      0.8335780              0.0158579        
P   1
  1      0.1934450              1.0000000        
P   1
  1      0.0561170              1.0000000        
D   7
  1    244.1474100              0.0020270        
  2     73.0675950              0.0165088        
  3     27.5920810              0.0703823        
  4     11.5465180              0.1911430        
  5      5.0486280              0.3254092        
  6      2.1784650              0.3678199        
  7      0.9002530              0.2744685        
D   1
  1      0.3373270              1.0000000        
D   1
  1      0.1169000              1.0000000        
F   1
  1      0.2881000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Ge
data:
GERMANIUM
S   18
  1 7447966.8000000             0.0000074        
  2 1115318.2000000             0.0000574        
  3 253842.6500000              0.0003019        
  4  71915.2850000              0.0012733        
  5  23470.1810000              0.0046123        
  6   8477.4918000              0.0148214        
  7   3308.3908000              0.0425536        
  8   1372.6054000              0.1073055        
  9    598.2200700              0.2245178        
 10    271.3860200              0.3453131        
 11    126.9779500              0.3045261        
 12     60.2220650              0.0990670        
 13     28.0185820              0.0041317        
 14     13.5175220              0.0010347        
 15      6.3094060             -0.0004856        
 16      2.9045340              0.0001805        
 17      1.2875560             -0.0000912        
 18      0.1677320             -0.0000266        
S   18
  1 7447966.8000000            -0.0000023        
  2 1115318.2000000            -0.0000179        
  3 253842.6500000             -0.0000940        
  4  71915.2850000             -0.0003964        
  5  23470.1810000             -0.0014425        
  6   8477.4918000             -0.0046675        
  7   3308.3908000             -0.0137153        
  8   1372.6054000             -0.0361797        
  9    598.2200700             -0.0841679        
 10    271.3860200             -0.1588767        
 11    126.9779500             -0.2033807        
 12     60.2220650             -0.0251410        
 13     28.0185820              0.4575152        
 14     13.5175220              0.5571939        
 15      6.3094060              0.1397055        
 16      2.9045340              0.0022645        
 17      1.2875560              0.0020927        
 18      0.1677320              0.0003281        
S   18
  1 7447966.8000000             0.0000009        
  2 1115318.2000000             0.0000069        
  3 253842.6500000              0.0000362        
  4  71915.2850000              0.0001528        
  5  23470.1810000              0.0005563        
  6   8477.4918000              0.0018018        
  7   3308.3908000              0.0053085        
  8   1372.6054000              0.0140877        
  9    598.2200700              0.0332013        
 10    271.3860200              0.0644621        
 11    126.9779500              0.0869540        
 12     60.2220650              0.0118745        
 13     28.0185820             -0.2724534        
 14     13.5175220             -0.5001452        
 15      6.3094060              0.0108554        
 16      2.9045340              0.7216469        
 17      1.2875560              0.4805213        
 18      0.1677320             -0.0102297        
S   18
  1 7447966.8000000            -0.0000002        
  2 1115318.2000000            -0.0000018        
  3 253842.6500000             -0.0000093        
  4  71915.2850000             -0.0000392        
  5  23470.1810000             -0.0001426        
  6   8477.4918000             -0.0004621        
  7   3308.3908000             -0.0013614        
  8   1372.6054000             -0.0036175        
  9    598.2200700             -0.0085359        
 10    271.3860200             -0.0166506        
 11    126.9779500             -0.0225911        
 12     60.2220650             -0.0032147        
 13     28.0185820              0.0744998        
 14     13.5175220              0.1440333        
 15      6.3094060             -0.0080815        
 16      2.9045340             -0.2704163        
 17      1.2875560             -0.3401607        
 18      0.1677320              0.6190657        
S   1
  1      0.3365520              1.0000000        
S   1
  1      0.0710690              1.0000000        
P   11
  1   6979.5982000              0.0004569        
  2   1654.1648000              0.0039562        
  3    536.0286500              0.0213143        
  4    203.5371300              0.0818715        
  5     85.2375300              0.2223732        
  6     37.8419620              0.3905659        
  7     17.4065120              0.3560415        
  8      7.8814920              0.1070312        
  9      3.5332130              0.0036941        
 10      1.5214730              0.0019219        
 11      0.1990930              0.0001917        
P   11
  1   6979.5982000             -0.0001756        
  2   1654.1648000             -0.0015305        
  3    536.0286500             -0.0083145        
  4    203.5371300             -0.0328718        
  5     85.2375300             -0.0931661        
  6     37.8419620             -0.1755542        
  7     17.4065120             -0.1467912        
  8      7.8814920              0.1862934        
  9      3.5332130              0.5264862        
 10      1.5214730              0.3970859        
 11      0.1990930             -0.0033478        
P   11
  1   6979.5982000              0.0000348        
  2   1654.1648000              0.0003014        
  3    536.0286500              0.0016487        
  4    203.5371300              0.0064982        
  5     85.2375300              0.0186383        
  6     37.8419620              0.0350613        
  7     17.4065120              0.0295892        
  8      7.8814920             -0.0472458        
  9      3.5332130             -0.1249847        
 10      1.5214730             -0.1210801        
 11      0.1990930              0.5754730        
P   1
  1      0.5627040              1.0000000        
P   1
  1      0.0670310              1.0000000        
D   7
  1    282.2391100              0.0018275        
  2     84.5499570              0.0151545        
  3     32.0736560              0.0660460        
  4     13.4974950              0.1839470        
  5      5.9585500              0.3227872        
  6      2.6107880              0.3729459        
  7      1.1039870              0.2751730        
D   1
  1      0.4240490              1.0000000        
D   1
  1      0.1520000              1.0000000        
F   1
  1      0.3458000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: As
data:
ARSENIC
S   18
  1 8482339.6000000             0.0000068        
  2 1270150.9000000             0.0000528        
  3 289056.9600000              0.0002774        
  4  81879.8490000              0.0011702        
  5  26716.5640000              0.0042421        
  6   9647.5842000              0.0136557        
  7   3764.1195000              0.0393399        
  8   1561.5656000              0.0999292        
  9    680.8146700              0.2121555        
 10    309.2411900              0.3363866        
 11    145.2573600              0.3155125        
 12     69.7390480              0.1181312        
 13     31.7703250              0.0080076        
 14     15.3917570              0.0003293        
 15      7.3415260             -0.0001523        
 16      3.3237160              0.0000247        
 17      1.4858670             -0.0000366        
 18      0.2115000             -0.0000094        
S   18
  1 8482339.6000000            -0.0000021        
  2 1270150.9000000            -0.0000165        
  3 289056.9600000             -0.0000866        
  4  81879.8490000             -0.0003653        
  5  26716.5640000             -0.0013309        
  6   9647.5842000             -0.0043093        
  7   3764.1195000             -0.0126973        
  8   1561.5656000             -0.0336160        
  9    680.8146700             -0.0789470        
 10    309.2411900             -0.1514458        
 11    145.2573600             -0.2042014        
 12     69.7390480             -0.0557367        
 13     31.7703250              0.4187607        
 14     15.3917570              0.5758762        
 15      7.3415260              0.1696842        
 16      3.3237160              0.0060662        
 17      1.4858670              0.0017605        
 18      0.2115000              0.0002316        
S   18
  1 8482339.6000000             0.0000008        
  2 1270150.9000000             0.0000064        
  3 289056.9600000              0.0000337        
  4  81879.8490000              0.0001423        
  5  26716.5640000              0.0005188        
  6   9647.5842000              0.0016802        
  7   3764.1195000              0.0049677        
  8   1561.5656000              0.0132115        
  9    680.8146700              0.0314566        
 10    309.2411900              0.0618446        
 11    145.2573600              0.0879566        
 12     69.7390480              0.0257548        
 13     31.7703250             -0.2455459        
 14     15.3917570             -0.5090572        
 15      7.3415260             -0.0555749        
 16      3.3237160              0.7083796        
 17      1.4858670              0.5231027        
 18      0.2115000             -0.0111176        
S   18
  1 8482339.6000000            -0.0000002        
  2 1270150.9000000            -0.0000018        
  3 289056.9600000             -0.0000093        
  4  81879.8490000             -0.0000392        
  5  26716.5640000             -0.0001429        
  6   9647.5842000             -0.0004629        
  7   3764.1195000             -0.0013687        
  8   1561.5656000             -0.0036440        
  9    680.8146700             -0.0086884        
 10    309.2411900             -0.0171556        
 11    145.2573600             -0.0245514        
 12     69.7390480             -0.0073524        
 13     31.7703250              0.0720087        
 14     15.3917570              0.1576254        
 15      7.3415260              0.0142074        
 16      3.3237160             -0.2851593        
 17      1.4858670             -0.3885347        
 18      0.2115000              0.6495337        
S   1
  1      0.4210860              1.0000000        
S   1
  1      0.0889740              1.0000000        
P   11
  1   7423.8614000              0.0004599        
  2   1759.5166000              0.0039823        
  3    570.2291600              0.0214638        
  4    216.5799700              0.0824617        
  5     90.7342520              0.2238902        
  6     40.3087910              0.3920704        
  7     18.5555020              0.3542238        
  8      8.3965430              0.1048641        
  9      3.7673670              0.0033664        
 10      1.6297010              0.0018495        
 11      0.2225030              0.0002297        
P   11
  1   7423.8614000             -0.0001794        
  2   1759.5166000             -0.0015641        
  3    570.2291600             -0.0084999        
  4    216.5799700             -0.0336327        
  5     90.7342520             -0.0953228        
  6     40.3087910             -0.1793626        
  7     18.5555020             -0.1466682        
  8      8.3965430              0.1966016        
  9      3.7673670              0.5372088        
 10      1.6297010              0.3857361        
 11      0.2225030             -0.0054006        
P   11
  1   7423.8614000              0.0000399        
  2   1759.5166000              0.0003488        
  3    570.2291600              0.0018953        
  4    216.5799700              0.0075325        
  5     90.7342520              0.0214315        
  6     40.3087910              0.0407807        
  7     18.5555020              0.0325249        
  8      8.3965430             -0.0548832        
  9      3.7673670             -0.1511922        
 10      1.6297010             -0.1249011        
 11      0.2225030              0.5855293        
P   1
  1      0.5682630              1.0000000        
P   1
  1      0.0804050              1.0000000        
D   7
  1    321.0196100              0.0016840        
  2     96.2493050              0.0141586        
  3     36.6449630              0.0628259        
  4     15.4939650              0.1784993        
  5      6.8911380              0.3209452        
  6      3.0548310              0.3773515        
  7      1.3142410              0.2750231        
D   1
  1      0.5134300              1.0000000        
D   1
  1      0.1877000              1.0000000        
F   1
  1      0.4158000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Se
data:
SELENIUM
S   18
  1 9563600.0000000             0.0000063        
  2 1432100.0000000             0.0000489        
  3 325910.0000000              0.0002574        
  4  92312.0000000              0.0010861        
  5  30116.0000000              0.0039399        
  6  10872.0000000              0.0127041        
  7   4240.1000000              0.0367156        
  8   1758.4000000              0.0938672        
  9    766.5900000              0.2017677        
 10    348.4300000              0.3280540        
 11    164.0300000              0.3238334        
 12     79.1420000              0.1352337        
 13     35.5240000              0.0117075        
 14     17.3050000             -0.0003436        
 15      8.3784000              0.0001665        
 16      3.7405000             -0.0001188        
 17      1.6890000              0.0000204        
 18      0.2552000              0.0000083        
S   18
  1 9563600.0000000            -0.0000020        
  2 1432100.0000000            -0.0000153        
  3 325910.0000000             -0.0000806        
  4  92312.0000000             -0.0003400        
  5  30116.0000000             -0.0012397        
  6  10872.0000000             -0.0040177        
  7   4240.1000000             -0.0118672        
  8   1758.4000000             -0.0315340        
  9    766.5900000             -0.0746439        
 10    348.4300000             -0.1452179        
 11    164.0300000             -0.2038441        
 12     79.1420000             -0.0788711        
 13     35.5240000              0.3845825        
 14     17.3050000              0.5865270        
 15      8.3784000              0.1973591        
 16      3.7405000              0.0100102        
 17      1.6890000              0.0013160        
 18      0.2552000              0.0001109        
S   18
  1 9563600.0000000             0.0000008        
  2 1432100.0000000             0.0000060        
  3 325910.0000000              0.0000317        
  4  92312.0000000              0.0001337        
  5  30116.0000000              0.0004883        
  6  10872.0000000              0.0015821        
  7   4240.1000000              0.0046919        
  8   1758.4000000              0.0125098        
  9    766.5900000              0.0300381        
 10    348.4300000              0.0597271        
 11    164.0300000              0.0884696        
 12     79.1420000              0.0363920        
 13     35.5240000             -0.2235329        
 14     17.3050000             -0.5122462        
 15      8.3784000             -0.1084224        
 16      3.7405000              0.6936372        
 17      1.6890000              0.5558711        
 18      0.2552000             -0.0113832        
S   18
  1 9563600.0000000            -0.0000002        
  2 1432100.0000000            -0.0000018        
  3 325910.0000000             -0.0000093        
  4  92312.0000000             -0.0000391        
  5  30116.0000000             -0.0001428        
  6  10872.0000000             -0.0004627        
  7   4240.1000000             -0.0013722        
  8   1758.4000000             -0.0036628        
  9    766.5900000             -0.0088061        
 10    348.4300000             -0.0175867        
 11    164.0300000             -0.0262074        
 12     79.1420000             -0.0109964        
 13     35.5240000              0.0695697        
 14     17.3050000              0.1683947        
 15      8.3784000              0.0346160        
 16      3.7405000             -0.2978702        
 17      1.6890000             -0.4322569        
 18      0.2552000              0.6757217        
S   1
  1      0.5092700              1.0000000        
S   1
  1      0.1065100              1.0000000        
P   11
  1   8004.3000000              0.0004505        
  2   1896.9000000              0.0039049        
  3    614.7100000              0.0210901        
  4    233.5000000              0.0812920        
  5     97.8560000              0.2217841        
  6     43.5140000              0.3907270        
  7     20.0630000              0.3559714        
  8      9.1127000              0.1073272        
  9      4.1063000              0.0036985        
 10      1.7949000              0.0018032        
 11      0.2461500              0.0002208        
P   11
  1   8004.3000000             -0.0001783        
  2   1896.9000000             -0.0015554        
  3    614.7100000             -0.0084727        
  4    233.5000000             -0.0336245        
  5     97.8560000             -0.0958267        
  6     43.5140000             -0.1813907        
  7     20.0630000             -0.1503152        
  8      9.1127000              0.1948263        
  9      4.1063000              0.5415554        
 10      1.7949000              0.3837299        
 11      0.2461500             -0.0050132        
P   11
  1   8004.3000000              0.0000430        
  2   1896.9000000              0.0003770        
  3    614.7100000              0.0020465        
  4    233.5000000              0.0081899        
  5     97.8560000              0.0233356        
  6     43.5140000              0.0449813        
  7     20.0630000              0.0357475        
  8      9.1127000             -0.0586866        
  9      4.1063000             -0.1709573        
 10      1.7949000             -0.1293583        
 11      0.2461500              0.5778069        
P   1
  1      0.6243200              1.0000000        
P   1
  1      0.0889170              1.0000000        
D   7
  1    361.8500000              0.0015655        
  2    108.5500000              0.0133262        
  3     41.4330000              0.0601527        
  4     17.5790000              0.1740293        
  5      7.8627000              0.3195690        
  6      3.5180000              0.3812029        
  7      1.5348000              0.2746086        
D   1
  1      0.6081300              1.0000000        
D   1
  1      0.2220000              1.0000000        
F   1
  1      0.4620000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Br
data:
BROMINE
S   18
  1 10639000.0000000            0.0000059        
  2 1593400.0000000             0.0000461        
  3 362610.0000000              0.0002422        
  4 102700.0000000              0.0010226        
  5  33501.0000000              0.0037113        
  6  12093.0000000              0.0119785        
  7   4715.9000000              0.0346927        
  8   1955.6000000              0.0891239        
  9    852.6100000              0.1934557        
 10    387.6700000              0.3209019        
 11    182.6800000              0.3299233        
 12     88.2450000              0.1494121        
 13     39.2630000              0.0149938        
 14     19.2340000             -0.0009165        
 15      9.4057000              0.0004380        
 16      4.1601000             -0.0002398        
 17      1.8995000              0.0000736        
 18      0.3011400              0.0000239        
S   18
  1 10639000.0000000           -0.0000019        
  2 1593400.0000000            -0.0000145        
  3 362610.0000000             -0.0000761        
  4 102700.0000000             -0.0003210        
  5  33501.0000000             -0.0011709        
  6  12093.0000000             -0.0037968        
  7   4715.9000000             -0.0112307        
  8   1955.6000000             -0.0299277        
  9    852.6100000             -0.0712706        
 10    387.6700000             -0.1403136        
 11    182.6800000             -0.2030763        
 12     88.2450000             -0.0960985        
 13     39.2630000              0.3558086        
 14     19.2340000              0.5921792        
 15      9.4057000              0.2215977        
 16      4.1601000              0.0137648        
 17      1.8995000              0.0008395        
 18      0.3011400             -0.0000085        
S   18
  1 10639000.0000000            0.0000007        
  2 1593400.0000000             0.0000057        
  3 362610.0000000              0.0000303        
  4 102700.0000000              0.0001275        
  5  33501.0000000              0.0004659        
  6  12093.0000000              0.0015096        
  7   4715.9000000              0.0044852        
  8   1955.6000000              0.0119835        
  9    852.6100000              0.0289571        
 10    387.6700000              0.0581566        
 11    182.6800000              0.0888133        
 12     88.2450000              0.0445244        
 13     39.2630000             -0.2060387        
 14     19.2340000             -0.5127017        
 15      9.4057000             -0.1509349        
 16      4.1601000              0.6789203        
 17      1.8995000              0.5817697        
 18      0.3011400             -0.0111825        
S   18
  1 10639000.0000000           -0.0000002        
  2 1593400.0000000            -0.0000018        
  3 362610.0000000             -0.0000093        
  4 102700.0000000             -0.0000391        
  5  33501.0000000             -0.0001428        
  6  12093.0000000             -0.0004628        
  7   4715.9000000             -0.0013750        
  8   1955.6000000             -0.0036784        
  9    852.6100000             -0.0088981        
 10    387.6700000             -0.0179529        
 11    182.6800000             -0.0275732        
 12     88.2450000             -0.0140953        
 13     39.2630000              0.0672561        
 14     19.2340000              0.1766928        
 15      9.4057000              0.0528861        
 16      4.1601000             -0.3075955        
 17      1.8995000             -0.4700658        
 18      0.3011400              0.6980341        
S   1
  1      0.6047200              1.0000000        
S   1
  1      0.1251500              1.0000000        
P   11
  1   8676.5000000              0.0004357        
  2   2055.9000000              0.0037815        
  3    666.2300000              0.0204782        
  4    253.1000000              0.0792834        
  5    106.1200000              0.2178473        
  6     47.2420000              0.3878585        
  7     21.8250000              0.3594350        
  8      9.9684000              0.1121995        
  9      4.5171000              0.0043874        
 10      1.9982000              0.0017809        
 11      0.2814500              0.0002122        
P   11
  1   8676.5000000             -0.0001748        
  2   2055.9000000             -0.0015263        
  3    666.2300000             -0.0083399        
  4    253.1000000             -0.0332203        
  5    106.1200000             -0.0954180        
  6     47.2420000             -0.1824026        
  7     21.8250000             -0.1558308        
  8      9.9684000              0.1867899        
  9      4.5171000              0.5427733        
 10      1.9982000              0.3873309        
 11      0.2814500             -0.0043784        
P   11
  1   8676.5000000              0.0000451        
  2   2055.9000000              0.0003964        
  3    666.2300000              0.0021555        
  4    253.1000000              0.0086720        
  5    106.1200000              0.0248680        
  6     47.2420000              0.0485472        
  7     21.8250000              0.0396156        
  8      9.9684000             -0.0605749        
  9      4.5171000             -0.1871699        
 10      1.9982000             -0.1377757        
 11      0.2814500              0.5760896        
P   1
  1      0.7098800              1.0000000        
P   1
  1      0.1020400              1.0000000        
D   7
  1    403.8300000              0.0014732        
  2    121.1700000              0.0126725        
  3     46.3450000              0.0580451        
  4     19.7210000              0.1705103        
  5      8.8624000              0.3185958        
  6      3.9962000              0.3845023        
  7      1.7636000              0.2737737        
D   1
  1      0.7061900              1.0000000        
D   1
  1      0.2639000              1.0000000        
F   1
  1      0.5515000              1.0000000


name: cc-pVTZ
description: VTZ2P Valence Triple Zeta + Polarization on All Atoms
elt: Kr
data:
KRYPTON
S   18
  1 11718113.0000000            0.0000056        
  2 1754604.4000000             0.0000438        
  3 399281.3200000              0.0002305        
  4 113084.5700000              0.0009733        
  5  36885.9250000              0.0035337        
  6  13312.2090000              0.0114167        
  7   5189.9883000              0.0331325        
  8   2151.6597000              0.0854464        
  9    938.0325100              0.1869124        
 10    426.5573200              0.3149761        
 11    201.0666000              0.3343334        
 12     97.0976050              0.1608810        
 13     42.9987240              0.0178435        
 14     21.1770750             -0.0013793        
 15     10.4267520              0.0006572        
 16      4.5850080             -0.0003388        
 17      2.1176030              0.0001211        
 18      0.3492250              0.0000366        
S   18
  1 11718113.0000000           -0.0000018        
  2 1754604.4000000            -0.0000138        
  3 399281.3200000             -0.0000726        
  4 113084.5700000             -0.0003063        
  5  36885.9250000             -0.0011177        
  6  13312.2090000             -0.0036270        
  7   5189.9883000             -0.0107432        
  8   2151.6597000             -0.0286992        
  9    938.0325100             -0.0686679        
 10    426.5573200             -0.1365155        
 11    201.0666000             -0.2022458        
 12     97.0976050             -0.1090569        
 13     42.9987240              0.3318768        
 14     21.1770750              0.5948250        
 15     10.4267520              0.2424825        
 16      4.5850080              0.0172241        
 17      2.1176030              0.0003685        
 18      0.3492250             -0.0001153        
S   18
  1 11718113.0000000            0.0000007        
  2 1754604.4000000             0.0000055        
  3 399281.3200000              0.0000292        
  4 113084.5700000              0.0001228        
  5  36885.9250000              0.0004491        
  6  13312.2090000              0.0014557        
  7   5189.9883000              0.0043319        
  8   2151.6597000              0.0115965        
  9    938.0325100              0.0281585        
 10    426.5573200              0.0570339        
 11    201.0666000              0.0891356        
 12     97.0976050              0.0508421        
 13     42.9987240             -0.1921030        
 14     21.1770750             -0.5121040        
 15     10.4267520             -0.1857007        
 16      4.5850080              0.6654119        
 17      2.1176030              0.6023925        
 18      0.3492250             -0.0106453        
S   18
  1 11718113.0000000           -0.0000002        
  2 1754604.4000000            -0.0000018        
  3 399281.3200000             -0.0000093        
  4 113084.5700000             -0.0000391        
  5  36885.9250000             -0.0001430        
  6  13312.2090000             -0.0004639        
  7   5189.9883000             -0.0013801        
  8   2151.6597000             -0.0037001        
  9    938.0325100             -0.0089921        
 10    426.5573200             -0.0183021        
 11    201.0666000             -0.0287559        
 12     97.0976050             -0.0167324        
 13     42.9987240              0.0652410        
 14     21.1770750              0.1834422        
 15     10.4267520              0.0692183        
 16      4.5850080             -0.3156034        
 17      2.1176030             -0.5031501        
 18      0.3492250              0.7171571        
S   1
  1      0.7070570              1.0000000        
S   1
  1      0.1448210              1.0000000        
P   11
  1   9366.3090000              0.0004231        
  2   2219.5543000              0.0036743        
  3    719.4528800              0.0199312        
  4    273.4644600              0.0774222        
  5    114.7522500              0.2140386        
  6     51.1555690              0.3848556        
  7     23.6826760              0.3626340        
  8     10.8754840              0.1170818        
  9      4.9551310              0.0051210        
 10      2.2172670              0.0017539        
 11      0.3221540              0.0002199        
P   11
  1   9366.3090000             -0.0001720        
  2   2219.5543000             -0.0015025        
  3    719.4528800             -0.0082269        
  4    273.4644600             -0.0328566        
  5    114.7522500             -0.0950135        
  6     51.1555690             -0.1833106        
  7     23.6826760             -0.1612161        
  8     10.8754840              0.1787644        
  9      4.9551310              0.5437885        
 10      2.2172670              0.3913387        
 11      0.3221540             -0.0047800        
P   11
  1   9366.3090000              0.0000466        
  2   2219.5543000              0.0004100        
  3    719.4528800              0.0022328        
  4    273.4644600              0.0090144        
  5    114.7522500              0.0260115        
  6     51.1555690              0.0513340        
  7     23.6826760              0.0430929        
  8     10.8754840             -0.0615040        
  9      4.9551310             -0.2003424        
 10      2.2172670             -0.1457364        
 11      0.3221540              0.5764581        
P   1
  1      0.8064100              1.0000000        
P   1
  1      0.1176190              1.0000000        
D   7
  1    446.1613300              0.0014044        
  2    133.9647700              0.0121715        
  3     51.3459070              0.0563919        
  4     21.9169060              0.1676430        
  5      9.8937250              0.3177368        
  6      4.4925270              0.3872647        
  7      2.0022930              0.2728006        
D   1
  1      0.8084090              1.0000000        
D   1
  1      0.3006000              1.0000000        
F   1
  1      0.6622000              1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: H
data:
HYDROGEN
S   3
  1      3.3870000E+01          6.07012756183E-03      
  2      5.0950000E+00          4.53130253451E-02      
  3      1.1590000E+00          2.02830146472E-01      
S   1
  1      3.2580000E-01          1.0000000        
S   1
  1      1.0270000E-01          1.0000000        
P   1
  1      1.4070000E+00          1.0000000        
P   1
  1      3.8800000E-01          1.0000000        
D   1
  1      1.0570000E+00          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      2.3400000E+02          2.59173011864E-03      
  2      3.5160000E+01          1.95443480520E-02      
  3      7.9890000E+00          9.10178889406E-02      
  4      2.2120000E+00          2.72061692005E-01      
S   1
  1      6.6690000E-01          1.0000000        
S   1
  1      2.0890000E-01          1.0000000        
P   1
  1      3.0440000E+00          1.0000000        
P   1
  1      7.5800000E-01          1.0000000        
D   1
  1      1.9650000E+00          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: B
data:
BORON
S   8
  1      5.4730000E+03          5.66571720528E-04      
  2      8.2090000E+02          4.32326588502E-03      
  3      1.8680000E+02          2.20292171781E-02      
  4      5.2830000E+01          8.45767298751E-02      
  5      1.7080000E+01          2.38673688259E-01      
  6      5.9990000E+00          4.34977318045E-01      
  7      2.2080000E+00          3.41681623511E-01      
  8      2.4150000E-01         -9.52942695519E-03      
S   8
  1      5.4730000E+03         -1.14575225132E-04      
  2      8.2090000E+02         -8.75507236066E-04      
  3      1.8680000E+02         -4.50274825995E-03      
  4      5.2830000E+01         -1.77235686847E-02      
  5      1.7080000E+01         -5.36906816899E-02      
  6      5.9990000E+00         -1.19055373326E-01      
  7      2.2080000E+00         -1.65664327968E-01      
  8      2.4150000E-01          5.95990141287E-01      
S   1
  1      5.8790000E-01          1.0000000        
S   1
  1      8.6100000E-02          1.0000000        
P   3
  1      1.2050000E+01          1.31332058143E-02      
  2      2.6130000E+00          7.98976586454E-02      
  3      7.4750000E-01          2.77228760199E-01      
P   1
  1      2.3850000E-01          1.0000000        
P   1
  1      7.6980000E-02          1.0000000        
D   1
  1      6.6100000E-01          1.0000000        
D   1
  1      1.9900000E-01          1.0000000        
F   1
  1      4.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: C
data:
CARBON
S   8
  1      8.2360000E+03          5.47014118602E-04      
  2      1.2350000E+03          4.15369492201E-03      
  3      2.8080000E+02          2.12020797706E-02      
  4      7.9270000E+01          8.20543624592E-02      
  5      2.5590000E+01          2.35001281820E-01      
  6      8.9970000E+00          4.34309709987E-01      
  7      3.3190000E+00          3.45723711126E-01      
  8      3.6430000E-01         -8.95870202722E-03      
S   8
  1      8.2360000E+03         -1.16969330473E-04      
  2      1.2350000E+03         -8.90823119588E-04      
  3      2.8080000E+02         -4.57976470187E-03      
  4      7.9270000E+01         -1.82393518444E-02      
  5      2.5590000E+01         -5.59821715033E-02      
  6      8.9970000E+00         -1.27311610064E-01      
  7      3.3190000E+00         -1.70627565860E-01      
  8      3.6430000E-01          6.00770442878E-01      
S   1
  1      9.0590000E-01          1.0000000        
S   1
  1      1.2850000E-01          1.0000000        
P   3
  1      1.8710000E+01          1.39581037151E-02      
  2      4.1330000E+00          8.64335008987E-02      
  3      1.2000000E+00          2.87330979905E-01      
P   1
  1      3.8270000E-01          1.0000000        
P   1
  1      1.2090000E-01          1.0000000        
D   1
  1      1.0970000E+00          1.0000000        
D   1
  1      3.1800000E-01          1.0000000        
F   1
  1      7.6100000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: N
data:
NITROGEN
S   8
  1      1.1420000E+04          5.44304421378E-04      
  2      1.7120000E+03          4.10742646286E-03      
  3      3.8930000E+02          2.09316048085E-02      
  4      1.1000000E+02          8.10066735625E-02      
  5      3.5570000E+01          2.33339045159E-01      
  6      1.2540000E+01          4.33406822595E-01      
  7      4.6440000E+00          3.46913284763E-01      
  8      5.1180000E-01         -8.47727227426E-03      
S   8
  1      1.1420000E+04         -1.20663854335E-04      
  2      1.7120000E+03         -9.14001126582E-04      
  3      3.8930000E+02         -4.68659915699E-03      
  4      1.1000000E+02         -1.87061486390E-02      
  5      3.5570000E+01         -5.77445784249E-02      
  6      1.2540000E+01         -1.32887505298E-01      
  7      4.6440000E+00         -1.73196097847E-01      
  8      5.1180000E-01          6.03916728423E-01      
S   1
  1      1.2930000E+00          1.0000000        
S   1
  1      1.7870000E-01          1.0000000        
P   3
  1      2.6630000E+01          1.45739816766E-02      
  2      5.9480000E+00          9.12175711975E-02      
  3      1.7420000E+00          2.94451502828E-01      
P   1
  1      5.5500000E-01          1.0000000        
P   1
  1      1.7250000E-01          1.0000000        
D   1
  1      1.6540000E+00          1.0000000        
D   1
  1      4.6900000E-01          1.0000000        
F   1
  1      1.0930000E+00          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: O
data:
OXYGEN
S   8
  1      1.5330000E+04          5.35476548130E-04      
  2      2.2990000E+03          4.00953615212E-03      
  3      5.2240000E+02          2.04440680208E-02      
  4      1.4730000E+02          7.95406172793E-02      
  5      4.7550000E+01          2.31030994628E-01      
  6      1.6760000E+01          4.32908229844E-01      
  7      6.2070000E+00          3.49518527226E-01      
  8      6.8820000E-01         -8.11912861550E-03      
S   8
  1      1.5330000E+04         -1.21817730887E-04      
  2      2.2990000E+03         -9.16141539700E-04      
  3      5.2240000E+02         -4.69613859638E-03      
  4      1.4730000E+02         -1.88698264427E-02      
  5      4.7550000E+01         -5.87113860912E-02      
  6      1.6760000E+01         -1.36812198710E-01      
  7      6.2070000E+00         -1.75492820819E-01      
  8      6.8820000E-01          6.04368703987E-01      
S   1
  1      1.7520000E+00          1.0000000        
S   1
  1      2.3840000E-01          1.0000000        
P   3
  1      3.4460000E+01          1.59703843364E-02      
  2      7.7490000E+00          9.97112774789E-02      
  3      2.2800000E+00          3.09578133685E-01      
P   1
  1      7.1560000E-01          1.0000000        
P   1
  1      2.1400000E-01          1.0000000        
D   1
  1      2.3140000E+00          1.0000000        
D   1
  1      6.4500000E-01          1.0000000        
F   1
  1      1.4280000E+00          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: F
data:
FLUORINE
S   8
  1      1.9500000E+04          5.41916557307E-04      
  2      2.9230000E+03          4.02458623271E-03      
  3      6.6450000E+02          2.04551219009E-02      
  4      1.8750000E+02          7.94659921903E-02      
  5      6.0620000E+01          2.30876541335E-01      
  6      2.1420000E+01          4.32578160986E-01      
  7      7.9500000E+00          3.49016894616E-01      
  8      8.8150000E-01         -7.84808413209E-03      
S   8
  1      1.9500000E+04         -1.25676540935E-04      
  2      2.9230000E+03         -9.38035609678E-04      
  3      6.6450000E+02         -4.78932634952E-03      
  4      1.8750000E+02         -1.92488282288E-02      
  5      6.0620000E+01         -5.98945339747E-02      
  6      2.1420000E+01         -1.40249495437E-01      
  7      7.9500000E+00         -1.76108990225E-01      
  8      8.8150000E-01          6.05014081649E-01      
S   1
  1      2.2570000E+00          1.0000000        
S   1
  1      3.0410000E-01          1.0000000        
P   3
  1      4.3880000E+01          1.67627501582E-02      
  2      9.9260000E+00          1.04596232332E-01      
  3      2.9300000E+00          3.17266992576E-01      
P   1
  1      9.1320000E-01          1.0000000        
P   1
  1      2.6720000E-01          1.0000000        
D   1
  1      3.1070000E+00          1.0000000        
D   1
  1      8.5500000E-01          1.0000000        
F   1
  1      1.9170000E+00          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ne
data:
NEON
S   8
  1      2.4350000E+04          5.44334814280E-04      
  2      3.6500000E+03          4.00628240001E-03      
  3      8.2960000E+02          2.03116905478E-02      
  4      2.3400000E+02          7.89839067224E-02      
  5      7.5610000E+01          2.30225222303E-01      
  6      2.6730000E+01          4.32357992760E-01      
  7      9.9270000E+00          3.49464384068E-01      
  8      1.1020000E+00         -7.59210366476E-03      
S   8
  1      2.4350000E+04         -1.28152530120E-04      
  2      3.6500000E+03         -9.48320845658E-04      
  3      8.2960000E+02         -4.82728659318E-03      
  4      2.3400000E+02         -1.94393693566E-02      
  5      7.5610000E+01         -6.06763981524E-02      
  6      2.6730000E+01         -1.42813150014E-01      
  7      9.9270000E+00         -1.76851798913E-01      
  8      1.1020000E+00          6.05782657761E-01      
S   1
  1      2.8360000E+00          1.0000000        
S   1
  1      3.7820000E-01          1.0000000        
P   3
  1      5.4700000E+01          1.72796425563E-02      
  2      1.2430000E+01          1.07827551473E-01      
  3      3.6790000E+00          3.21701535500E-01      
P   1
  1      1.1430000E+00          1.0000000        
P   1
  1      3.3000000E-01          1.0000000        
D   1
  1      4.0140000E+00          1.0000000        
D   1
  1      1.0960000E+00          1.0000000        
F   1
  1      2.5440000E+00          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   13
  1      2.0550000E+05          8.92685357937E-05      
  2      3.0780000E+04          5.89465080590E-04      
  3      7.0060000E+03          2.92725663348E-03      
  4      1.9850000E+03          1.18379237025E-02      
  5      6.4910000E+02          4.05044271820E-02      
  6      2.3500000E+02          1.15976546482E-01      
  7      9.1620000E+01          2.61441068701E-01      
  8      3.7670000E+01          3.95437209482E-01      
  9      1.5910000E+01          2.82872710203E-01      
 10      5.8500000E+00          4.40499560194E-02      
 11      2.5420000E+00         -4.84263758230E-03      
 12      1.0570000E+00          2.58455817955E-03      
 13      1.4550000E-01          7.13662098733E-04      
S   13
  1      2.0550000E+05         -2.33181627495E-05      
  2      3.0780000E+04         -1.54272748472E-04      
  3      7.0060000E+03         -7.66220820612E-04      
  4      1.9850000E+03         -3.12532135841E-03      
  5      6.4910000E+02         -1.08430893838E-02      
  6      2.3500000E+02         -3.25757408494E-02      
  7      9.1620000E+01         -8.08496627061E-02      
  8      3.7670000E+01         -1.57066771281E-01      
  9      1.5910000E+01         -1.66773426387E-01      
 10      5.8500000E+00          1.30025819677E-01      
 11      2.5420000E+00          5.61965866817E-01      
 12      1.0570000E+00          4.33689208274E-01      
 13      1.4550000E-01         -1.10637849577E-02      
S   13
  1      2.0550000E+05          5.38563460836E-06      
  2      3.0780000E+04          3.56101061863E-05      
  3      7.0060000E+03          1.77069501551E-04      
  4      1.9850000E+03          7.21566948209E-04      
  5      6.4910000E+02          2.51125620267E-03      
  6      2.3500000E+02          7.55180587974E-03      
  7      9.1620000E+01          1.89492578364E-02      
  8      3.7670000E+01          3.73660137348E-02      
  9      1.5910000E+01          4.15078478805E-02      
 10      5.8500000E+00         -3.62504940857E-02      
 11      2.5420000E+00         -1.75959315718E-01      
 12      1.0570000E+00         -2.74771499576E-01      
 13      1.4550000E-01          6.52075171921E-01      
S   1
  1      2.9310000E-01          1.0000000        
S   1
  1      5.6500000E-02          1.0000000        
P   7
  1      4.4440000E+02          1.70630809514E-03      
  2      1.0510000E+02          1.32459513729E-02      
  3      3.3470000E+01          6.15792593242E-02      
  4      1.2330000E+01          1.88171835498E-01      
  5      4.8690000E+00          3.60407335542E-01      
  6      1.9610000E+00          4.08053495002E-01      
  7      1.8880000E-01          9.79137282793E-03      
P   7
  1      4.4440000E+02         -3.00262909705E-04      
  2      1.0510000E+02         -2.45368428625E-03      
  3      3.3470000E+01         -1.09211781614E-02      
  4      1.2330000E+01         -3.64575930816E-02      
  5      4.8690000E+00         -6.40293947289E-02      
  6      1.9610000E+00         -9.70583411211E-02      
  7      1.8880000E-01          5.02691601618E-01      
P   1
  1      7.8340000E-01          1.0000000        
P   1
  1      5.5570000E-02          1.0000000        
D   1
  1      3.3300000E-01          1.0000000        
D   1
  1      1.0900000E-01          1.0000000        
F   1
  1      2.4400000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Si
data:
SILICON
S   13
  1      2.5490000E+05          8.61845049213E-05      
  2      3.8190000E+04          5.54452187602E-04      
  3      8.6900000E+03          2.72794113904E-03      
  4      2.4620000E+03          1.09927694536E-02      
  5      8.0480000E+02          3.76475986583E-02      
  6      2.9130000E+02          1.08558848558E-01      
  7      1.1360000E+02          2.48655791073E-01      
  8      4.6750000E+01          3.89970909003E-01      
  9      1.9820000E+01          2.99986788658E-01      
 10      7.7080000E+00          5.53425944587E-02      
 11      3.3400000E+00         -3.97070550037E-03      
 12      1.4020000E+00          2.54796344837E-03      
 13      2.0700000E-01          5.99642112421E-04      
S   13
  1      2.5490000E+05         -2.30780213768E-05      
  2      3.8190000E+04         -1.48627196624E-04      
  3      8.6900000E+03         -7.32369384886E-04      
  4      2.4620000E+03         -2.96987522601E-03      
  5      8.0480000E+02         -1.03311904739E-02      
  6      2.9130000E+02         -3.10842143078E-02      
  7      1.1360000E+02         -7.83763426352E-02      
  8      4.6750000E+01         -1.54593611021E-01      
  9      1.9820000E+01         -1.78729698663E-01      
 10      7.7080000E+00          8.34475753903E-02      
 11      3.3400000E+00          5.48621689735E-01      
 12      1.4020000E+00          4.76628472712E-01      
 13      2.0700000E-01         -1.03266305383E-02      
S   13
  1      2.5490000E+05          5.92290019496E-06      
  2      3.8190000E+04          3.81255634496E-05      
  3      8.6900000E+03          1.88063530215E-04      
  4      2.4620000E+03          7.62044113297E-04      
  5      8.0480000E+02          2.65872445632E-03      
  6      2.9130000E+02          8.01015836135E-03      
  7      1.1360000E+02          2.04167393152E-02      
  8      4.6750000E+01          4.09151149030E-02      
  9      1.9820000E+01          4.95191616884E-02      
 10      7.7080000E+00         -2.60551203120E-02      
 11      3.3400000E+00         -1.91836066549E-01      
 12      1.4020000E+00         -3.17417056559E-01      
 13      2.0700000E-01          6.81672065466E-01      
S   1
  1      4.3870000E-01          1.0000000        
S   1
  1      7.9440000E-02          1.0000000        
P   7
  1      4.8150000E+02          2.02259064314E-03      
  2      1.1390000E+02          1.55877369850E-02      
  3      3.6230000E+01          7.18465184884E-02      
  4      1.3340000E+01          2.13415104749E-01      
  5      5.2520000E+00          3.90243969649E-01      
  6      2.1200000E+00          3.93166798342E-01      
  7      2.5280000E-01          4.06221561453E-03      
P   7
  1      4.8150000E+02         -4.24172993771E-04      
  2      1.1390000E+02         -3.39456519536E-03      
  3      3.6230000E+01         -1.52727181634E-02      
  4      1.3340000E+01         -4.88161633324E-02      
  5      5.2520000E+00         -8.46273117519E-02      
  6      2.1200000E+00         -1.12377521066E-01      
  7      2.5280000E-01          5.35323482473E-01      
P   1
  1      8.5610000E-01          1.0000000        
P   1
  1      7.8890000E-02          1.0000000        
D   1
  1      4.8100000E-01          1.0000000        
D   1
  1      1.5900000E-01          1.0000000        
F   1
  1      3.3600000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: P
data:
PHOSPHORUS
S   13
  1      3.1240000E+05          8.36796876767E-05      
  2      4.6800000E+04          5.23821509102E-04      
  3      1.0650000E+04          2.54972474402E-03      
  4      3.0180000E+03          1.02277794002E-02      
  5      9.8680000E+02          3.49990138339E-02      
  6      3.5740000E+02          1.01430028081E-01      
  7      1.3960000E+02          2.35276851219E-01      
  8      5.7630000E+01          3.81518605917E-01      
  9      2.4600000E+01          3.15738150367E-01      
 10      1.0120000E+01          6.99607414635E-02      
 11      4.2830000E+00         -1.78827083478E-03      
 12      1.8050000E+00          2.13027456460E-03      
 13      2.7820000E-01          4.25637030984E-04      
S   13
  1      3.1240000E+05         -2.28857046186E-05      
  2      4.6800000E+04         -1.43311467189E-04      
  3      1.0650000E+04         -6.99502609565E-04      
  4      3.0180000E+03         -2.81785324765E-03      
  5      9.8680000E+02         -9.80910725262E-03      
  6      3.5740000E+02         -2.95076676962E-02      
  7      1.3960000E+02         -7.52889324685E-02      
  8      5.7630000E+01         -1.50398438540E-01      
  9      2.4600000E+01         -1.87905970406E-01      
 10      1.0120000E+01          4.04263957404E-02      
 11      4.2830000E+00          5.30965526653E-01      
 12      1.8050000E+00          5.15035293198E-01      
 13      2.7820000E-01         -8.95421492471E-03      
S   13
  1      3.1240000E+05          6.31032071273E-06      
  2      4.6800000E+04          3.94894320826E-05      
  3      1.0650000E+04          1.93006137834E-04      
  4      3.0180000E+03          7.76598013509E-04      
  5      9.8680000E+02          2.71283572132E-03      
  6      3.5740000E+02          8.16619894026E-03      
  7      1.3960000E+02          2.10832933614E-02      
  8      5.7630000E+01          4.27315217959E-02      
  9      2.4600000E+01          5.60483812876E-02      
 10      1.0120000E+01         -1.41583781818E-02      
 11      4.2830000E+00         -1.98690691312E-01      
 12      1.8050000E+00         -3.53660476849E-01      
 13      2.7820000E-01          7.02966621044E-01      
S   1
  1      6.1580000E-01          1.0000000        
S   1
  1      1.0550000E-01          1.0000000        
P   7
  1      5.0490000E+02          2.47035228108E-03      
  2      1.1940000E+02          1.88440045128E-02      
  3      3.7960000E+01          8.55320670104E-02      
  4      1.3950000E+01          2.45007757404E-01      
  5      5.4570000E+00          4.22480983818E-01      
  6      2.1770000E+00          3.67646642206E-01      
  7      2.8770000E-01         -3.34305866077E-03      
P   7
  1      5.0490000E+02         -5.83555235996E-04      
  2      1.1940000E+02         -4.50935701909E-03      
  3      3.7960000E+01         -2.06503641985E-02      
  4      1.3950000E+01         -6.15418359374E-02      
  5      5.4570000E+00         -1.08137367384E-01      
  6      2.1770000E+00         -1.04760070135E-01      
  7      2.8770000E-01          5.46204204931E-01      
P   1
  1      8.0100000E-01          1.0000000        
P   1
  1      9.7140000E-02          1.0000000        
D   1
  1      6.5200000E-01          1.0000000        
D   1
  1      2.1600000E-01          1.0000000        
F   1
  1      4.5200000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: S
data:
SULFUR
S   13
  1      3.7410000E+05          8.27922004098E-05      
  2      5.6050000E+04          5.03770124510E-04      
  3      1.2760000E+04          2.42692557821E-03      
  4      3.6150000E+03          9.68206363872E-03      
  5      1.1830000E+03          3.30545366628E-02      
  6      4.2880000E+02          9.60492400559E-02      
  7      1.6780000E+02          2.24721988311E-01      
  8      6.9470000E+01          3.73516358300E-01      
  9      2.9840000E+01          3.26453360659E-01      
 10      1.2720000E+01          8.36266395512E-02      
 11      5.2440000E+00          4.39407290892E-04      
 12      2.2190000E+00          1.62113961512E-03      
 13      3.4900000E-01          2.95532265788E-04      
S   13
  1      3.7410000E+05         -2.30578594159E-05      
  2      5.6050000E+04         -1.40286627018E-04      
  3      1.2760000E+04         -6.78322370134E-04      
  4      3.6150000E+03         -2.71356057908E-03      
  5      1.1830000E+03         -9.43455370665E-03      
  6      4.2880000E+02         -2.83460289804E-02      
  7      1.6780000E+02         -7.29018376514E-02      
  8      6.9470000E+01         -1.46992552672E-01      
  9      2.9840000E+01         -1.93625529563E-01      
 10      1.2720000E+01          1.28102095981E-02      
 11      5.2440000E+00          5.19562123155E-01      
 12      2.2190000E+00          5.37437219009E-01      
 13      3.4900000E-01         -8.84576029201E-03      
S   13
  1      3.7410000E+05          6.70250430001E-06      
  2      5.6050000E+04          4.07599941258E-05      
  3      1.2760000E+04          1.97294147054E-04      
  4      3.6150000E+03          7.88653825486E-04      
  5      1.1830000E+03          2.75022756611E-03      
  6      4.2880000E+02          8.27419147740E-03      
  7      1.6780000E+02          2.15150451780E-02      
  8      6.9470000E+01          4.40677301122E-02      
  9      2.9840000E+01          6.08089750340E-02      
 10      1.2720000E+01         -5.18904339080E-03      
 11      5.2440000E+00         -2.06853712666E-01      
 12      2.2190000E+00         -3.80130789264E-01      
 13      3.4900000E-01          7.14465114487E-01      
S   1
  1      7.7670000E-01          1.0000000        
S   1
  1      1.3220000E-01          1.0000000        
P   7
  1      5.7440000E+02          2.58046240337E-03      
  2      1.3580000E+02          1.96437659097E-02      
  3      4.3190000E+01          8.92245746841E-02      
  4      1.5870000E+01          2.55140430174E-01      
  5      6.2080000E+00          4.33654270789E-01      
  6      2.4830000E+00          3.54054101372E-01      
  7      3.2290000E-01         -4.78797462597E-03      
P   7
  1      5.7440000E+02         -6.60500211478E-04      
  2      1.3580000E+02         -5.03180858630E-03      
  3      4.3190000E+01         -2.34455832580E-02      
  4      1.5870000E+01         -6.85962253841E-02      
  5      6.2080000E+00         -1.23781546062E-01      
  6      2.4830000E+00         -9.61116306798E-02      
  7      3.2290000E-01          5.62507481479E-01      
P   1
  1      8.6880000E-01          1.0000000        
P   1
  1      1.0980000E-01          1.0000000        
D   1
  1      8.1900000E-01          1.0000000        
D   1
  1      2.6900000E-01          1.0000000        
F   1
  1      5.5700000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   13
  1      4.5610000E+05          7.98780004609E-05      
  2      6.8330000E+04          4.71647196634E-04      
  3      1.5550000E+04          2.24356709260E-03      
  4      4.4050000E+03          8.91037398867E-03      
  5      1.4390000E+03          3.04920325874E-02      
  6      5.2040000E+02          8.93689434739E-02      
  7      2.0310000E+02          2.12790591283E-01      
  8      8.3960000E+01          3.64594399105E-01      
  9      3.6200000E+01          3.37933791612E-01      
 10      1.5830000E+01          1.00714767635E-01      
 11      6.3340000E+00          3.06808696190E-03      
 12      2.6940000E+00          1.03794241999E-03      
 13      4.3130000E-01          1.52201288071E-04      
S   13
  1      4.5610000E+05         -2.26003098317E-05      
  2      6.8330000E+04         -1.33380025159E-04      
  3      1.5550000E+04         -6.37328942043E-04      
  4      4.4050000E+03         -2.53429395610E-03      
  5      1.4390000E+03         -8.83825710318E-03      
  6      5.2040000E+02         -2.66700583809E-02      
  7      2.0310000E+02         -6.96701322431E-02      
  8      8.3960000E+01         -1.42554181644E-01      
  9      3.6200000E+01         -1.97927564465E-01      
 10      1.5830000E+01         -1.43754525146E-02      
 11      6.3340000E+00          5.03709960078E-01      
 12      2.6940000E+00          5.58321306489E-01      
 13      4.3130000E-01         -8.03615707583E-03      
S   13
  1      4.5610000E+05          6.84198414246E-06      
  2      6.8330000E+04          4.03607567964E-05      
  3      1.5550000E+04          1.93066735221E-04      
  4      4.4050000E+03          7.67086538498E-04      
  5      1.4390000E+03          2.68329843072E-03      
  6      5.2040000E+02          8.10682093436E-03      
  7      2.0310000E+02          2.14104314650E-02      
  8      8.3960000E+01          4.44804820717E-02      
  9      3.6200000E+01          6.46759005593E-02      
 10      1.5830000E+01          4.20908824917E-03      
 11      6.3340000E+00         -2.09302557216E-01      
 12      2.6940000E+00         -4.03267150530E-01      
 13      4.3130000E-01          7.25626329584E-01      
S   1
  1      9.7680000E-01          1.0000000        
S   1
  1      1.6250000E-01          1.0000000        
P   7
  1      6.6330000E+02          2.58549969600E-03      
  2      1.5680000E+02          1.96381829148E-02      
  3      4.9980000E+01          8.93214324333E-02      
  4      1.8420000E+01          2.56637063566E-01      
  5      7.2400000E+00          4.36602785772E-01      
  6      2.9220000E+00          3.49296039064E-01      
  7      3.8180000E-01         -4.55241301669E-03      
P   7
  1      6.6330000E+02         -7.01290200984E-04      
  2      1.5680000E+02         -5.31066747282E-03      
  3      4.9980000E+01         -2.49246690162E-02      
  4      1.8420000E+01         -7.29627983827E-02      
  5      7.2400000E+00         -1.33873089775E-01      
  6      2.9220000E+00         -9.40188572185E-02      
  7      3.8180000E-01          5.64046929080E-01      
P   1
  1      1.0220000E+00          1.0000000        
P   1
  1      1.3010000E-01          1.0000000        
D   1
  1      1.0460000E+00          1.0000000        
D   1
  1      3.4400000E-01          1.0000000        
F   1
  1      7.0600000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ar
data:
ARGON
S   13
  1      5.4500000E+05          7.84189526946E-05      
  2      8.1640000E+04          4.49107173780E-04      
  3      1.8580000E+04          2.10988383736E-03      
  4      5.2610000E+03          8.33239495771E-03      
  5      1.7170000E+03          2.85300266852E-02      
  6      6.1990000E+02          8.40815610477E-02      
  7      2.4160000E+02          2.02777516390E-01      
  8      9.9790000E+01          3.56127524975E-01      
  9      4.3150000E+01          3.46322830406E-01      
 10      1.9140000E+01          1.16472056472E-01      
 11      7.4880000E+00          5.49757157786E-03      
 12      3.2050000E+00          4.73895020368E-04      
 13      5.2040000E-01          2.76626107805E-05      
S   13
  1      5.4500000E+05         -2.24966929237E-05      
  2      8.1640000E+04         -1.28753875666E-04      
  3      1.8580000E+04         -6.07933130632E-04      
  4      5.2610000E+03         -2.40142217463E-03      
  5      1.7170000E+03         -8.38240953869E-03      
  6      6.1990000E+02         -2.53562310298E-02      
  7      2.4160000E+02         -6.69535536580E-02      
  8      9.9790000E+01         -1.38763275270E-01      
  9      4.3150000E+01         -2.00369152264E-01      
 10      1.9140000E+01         -3.54578819381E-02      
 11      7.4880000E+00          4.89698817461E-01      
 12      3.2050000E+00          5.73102406301E-01      
 13      5.2040000E-01         -7.00610638022E-03      
S   13
  1      5.4500000E+05          7.03553042467E-06      
  2      8.1640000E+04          4.02484050988E-05      
  3      1.8580000E+04          1.90249515602E-04      
  4      5.2610000E+03          7.50883454540E-04      
  5      1.7170000E+03          2.62896706863E-03      
  6      6.1990000E+02          7.96147266176E-03      
  7      2.4160000E+02          2.12516372256E-02      
  8      9.9790000E+01          4.47054827347E-02      
  9      4.3150000E+01          6.75671714938E-02      
 10      1.9140000E+01          1.20129326661E-02      
 11      7.4880000E+00         -2.10940928100E-01      
 12      3.2050000E+00         -4.22093166344E-01      
 13      5.2040000E-01          7.33760409209E-01      
S   1
  1      1.1960000E+00          1.0000000        
S   1
  1      1.9540000E-01          1.0000000        
P   7
  1      7.6180000E+02          2.57456354920E-03      
  2      1.8020000E+02          1.95033097460E-02      
  3      5.7500000E+01          8.90215520831E-02      
  4      2.1240000E+01          2.57119390620E-01      
  5      8.3880000E+00          4.38352552293E-01      
  6      3.4160000E+00          3.46329665187E-01      
  7      4.5230000E-01         -5.20294481411E-03      
P   7
  1      7.6180000E+02         -7.24960571951E-04      
  2      1.8020000E+02         -5.46544792730E-03      
  3      5.7500000E+01         -2.58304060727E-02      
  4      2.1240000E+01         -7.59131009547E-02      
  5      8.3880000E+00         -1.40959699869E-01      
  6      3.4160000E+00         -9.23189976025E-02      
  7      4.5230000E-01          5.61752008335E-01      
P   1
  1      1.2060000E+00          1.0000000        
P   1
  1      1.5450000E-01          1.0000000        
D   1
  1      1.2540000E+00          1.0000000        
D   1
  1      4.1000000E-01          1.0000000        
F   1
  1      8.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ga
data:
GALLIUM
S   18
  1      6.5581573E+06          4.51413130173E-05      
  2      9.8202534E+05          1.66315256985E-04      
  3      2.2346769E+05          5.98898991050E-04      
  4      6.3288291E+04          1.99327971462E-03      
  5      2.0642940E+04          6.28997852675E-03      
  6      7.4505224E+03          1.84942531265E-02      
  7      2.9050744E+03          5.00060692027E-02      
  8      1.2042100E+03          1.20188873368E-01      
  9      5.2430454E+02          2.40201988951E-01      
 10      2.3746563E+02          3.48704464917E-01      
 11      1.1057866E+02          2.82069515157E-01      
 12      5.1374624E+01          7.72446002649E-02      
 13      2.4440846E+01          7.12812998307E-04      
 14      1.1768591E+01          1.50834335070E-03      
 15      5.3421190E+00         -7.04915557538E-04      
 16      2.4950360E+00          2.90336528051E-04      
 17      1.0987730E+00         -1.21437877599E-04      
 18      2.6018000E-01          4.75838043049E-05      
S   18
  1      6.5581573E+06         -1.43386911541E-05      
  2      9.8202534E+05         -5.29901969766E-05      
  3      2.2346769E+05         -1.91431160382E-04      
  4      6.3288291E+04         -6.38961926323E-04      
  5      2.0642940E+04         -2.02719796073E-03      
  6      7.4505224E+03         -6.01461277105E-03      
  7      2.9050744E+03         -1.66451093880E-02      
  8      1.2042100E+03         -4.19817372410E-02      
  9      5.2430454E+02         -9.34389558989E-02      
 10      2.3746563E+02         -1.67873331626E-01      
 11      1.1057866E+02         -1.92327490110E-01      
 12      5.1374624E+01          3.18446791724E-02      
 13      2.4440846E+01          5.06763313622E-01      
 14      1.1768591E+01          5.11798214842E-01      
 15      5.3421190E+00          1.01248101527E-01      
 16      2.4950360E+00         -5.20745192317E-04      
 17      1.0987730E+00          1.95174002567E-03      
 18      2.6018000E-01         -4.14185640772E-04      
S   18
  1      6.5581573E+06          5.48942357566E-06      
  2      9.8202534E+05          2.02985721719E-05      
  3      2.2346769E+05          7.33309802391E-05      
  4      6.3288291E+04          2.45002688911E-04      
  5      2.0642940E+04          7.77143085810E-04      
  6      7.4505224E+03          2.31109169975E-03      
  7      2.9050744E+03          6.40478078720E-03      
  8      1.2042100E+03          1.62849789483E-02      
  9      5.2430454E+02          3.66571173840E-02      
 10      2.3746563E+02          6.80535240374E-02      
 11      1.1057866E+02          8.16364483069E-02      
 12      5.1374624E+01         -1.52395995523E-02      
 13      2.4440846E+01         -3.14543464350E-01      
 14      1.1768591E+01         -4.70554719151E-01      
 15      5.3421190E+00          1.20788010662E-01      
 16      2.4950360E+00          7.33494134914E-01      
 17      1.0987730E+00          4.04667124345E-01      
 18      2.6018000E-01          1.69324815888E-02      
S   18
  1      6.5581573E+06         -1.28701317080E-06      
  2      9.8202534E+05         -4.76101110690E-06      
  3      2.2346769E+05         -1.71889751986E-05      
  4      6.3288291E+04         -5.74939002065E-05      
  5      2.0642940E+04         -1.82103919072E-04      
  6      7.4505224E+03         -5.42748102048E-04      
  7      2.9050744E+03         -1.50071182411E-03      
  8      1.2042100E+03         -3.83185326123E-03      
  9      5.2430454E+02         -8.60302290690E-03      
 10      2.3746563E+02         -1.61350663086E-02      
 11      1.1057866E+02         -1.92660981838E-02      
 12      5.1374624E+01          3.30120929648E-03      
 13      2.4440846E+01          7.97415946861E-02      
 14      1.1768591E+01          1.22535575256E-01      
 15      5.3421190E+00         -3.72277757686E-02      
 16      2.4950360E+00         -2.62310948672E-01      
 17      1.0987730E+00         -2.68290924974E-01      
 18      2.6018000E-01          3.44864613661E-01      
S   1
  1      1.2707900E-01          1.0000000        
S   1
  1      5.4408000E-02          1.0000000        
P   11
  1      8.0501674E+03          5.56267556715E-04      
  2      1.9075361E+03          3.33175807166E-03      
  3      6.1862746E+02          1.65913029207E-02      
  4      2.3532417E+02          6.26494261631E-02      
  5      9.8899646E+01          1.76708586518E-01      
  6      4.4248215E+01          3.42172946061E-01      
  7      2.0617429E+01          3.86265084458E-01      
  8      9.7805160E+00          1.80163908223E-01      
  9      4.4412380E+00          2.12680856146E-02      
 10      1.9640450E+00          1.11449281392E-03      
 11      8.3357800E-01          2.75216613643E-04      
P   11
  1      8.0501674E+03         -2.12196352741E-04      
  2      1.9075361E+03         -1.27277668714E-03      
  3      6.1862746E+02         -6.41359863657E-03      
  4      2.3532417E+02         -2.46359063624E-02      
  5      9.8899646E+01         -7.25379720551E-02      
  6      4.4248215E+01         -1.47428884068E-01      
  7      2.0617429E+01         -1.74634750239E-01      
  8      9.7805160E+00          4.26603616286E-02      
  9      4.4412380E+00          4.27338546893E-01      
 10      1.9640450E+00          4.91488350621E-01      
 11      8.3357800E-01          1.75144467366E-01      
P   11
  1      8.0501674E+03          3.49757197515E-05      
  2      1.9075361E+03          2.05038373022E-04      
  3      6.1862746E+02          1.06434718791E-03      
  4      2.3532417E+02          3.96737612815E-03      
  5      9.8899646E+01          1.21755613348E-02      
  6      4.4248215E+01          2.36408402722E-02      
  7      2.0617429E+01          3.10085728003E-02      
  8      9.7805160E+00         -1.49207308058E-02      
  9      4.4412380E+00         -7.37764975989E-02      
 10      1.9640450E+00         -1.26371524036E-01      
 11      8.3357800E-01          2.02532299724E-02      
P   1
  1      1.9344500E-01          1.0000000        
P   1
  1      5.6117000E-02          1.0000000        
D   7
  1      2.4414741E+02          2.11045359243E-03      
  2      7.3067595E+01          1.66136827340E-02      
  3      2.7592081E+01          7.01404156855E-02      
  4      1.1546518E+01          1.89939407645E-01      
  5      5.0486280E+00          3.23960195865E-01      
  6      2.1784650E+00          3.66700881545E-01      
  7      9.0025300E-01          2.77287519469E-01      
D   1
  1      3.3732700E-01          1.0000000        
D   1
  1      1.1690000E-01          1.0000000        
F   1
  1      2.8810000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   18
  1      7.4479668E+06          4.54768249588E-05      
  2      1.1153182E+06          1.63961626996E-04      
  3      2.5384265E+05          5.79595225551E-04      
  4      7.1915285E+04          1.89911021957E-03      
  5      2.3470181E+04          5.92773481023E-03      
  6      8.4774918E+03          1.73079405863E-02      
  7      3.3083908E+03          4.66725938053E-02      
  8      1.3726054E+03          1.12568875702E-01      
  9      5.9822007E+02          2.27900335797E-01      
 10      2.7138602E+02          3.41341901652E-01      
 11      1.2697795E+02          2.94526944553E-01      
 12      6.0222065E+01          9.40890042298E-02      
 13      2.8018582E+01          3.86122870958E-03      
 14      1.3517522E+01          9.64955450234E-04      
 15      6.3094060E+00         -4.53759553678E-04      
 16      2.9045340E+00          1.65317178788E-04      
 17      1.2875560E+00         -8.42645151390E-05      
 18      1.6773200E-01         -2.44934031074E-05      
S   18
  1      7.4479668E+06         -1.45164368699E-05      
  2      1.1153182E+06         -5.24948247574E-05      
  3      2.5384265E+05         -1.86241179469E-04      
  4      7.1915285E+04         -6.11818771709E-04      
  5      2.3470181E+04         -1.92113540206E-03      
  6      8.4774918E+03         -5.65304691209E-03      
  7      3.3083908E+03         -1.55998337306E-02      
  8      1.3726054E+03         -3.93056817359E-02      
  9      5.9822007E+02         -8.82120642077E-02      
 10      2.7138602E+02         -1.60803801256E-01      
 11      1.2697795E+02         -1.96398769560E-01      
 12      6.0222065E+01         -4.22629613637E-03      
 13      2.8018582E+01          4.72497768904E-01      
 14      1.3517522E+01          5.39478288704E-01      
 15      6.3094060E+00          1.27782993444E-01      
 16      2.9045340E+00          1.89496170542E-03      
 17      1.2875560E+00          1.89128570149E-03      
 18      1.6773200E-01          2.86614158006E-04      
S   18
  1      7.4479668E+06          5.61578293193E-06      
  2      1.1153182E+06          2.03168500277E-05      
  3      2.5384265E+05          7.21043051201E-05      
  4      7.1915285E+04          2.36990124670E-04      
  5      2.3470181E+04          7.44514201497E-04      
  6      8.4774918E+03          2.19374203820E-03      
  7      3.3083908E+03          6.06856416637E-03      
  8      1.3726054E+03          1.53862495209E-02      
  9      5.9822007E+02          3.49658373155E-02      
 10      2.7138602E+02          6.55684030861E-02      
 11      1.2697795E+02          8.41187297552E-02      
 12      6.0222065E+01          1.15124708374E-03      
 13      2.8018582E+01         -2.87188044858E-01      
 14      1.3517522E+01         -4.90517809039E-01      
 15      6.3094060E+00          4.46758635628E-02      
 16      2.9045340E+00          7.31337506839E-01      
 17      1.2875560E+00          4.53659134612E-01      
 18      1.6773200E-01         -7.97349999002E-03      
S   18
  1      7.4479668E+06         -1.45056604680E-06      
  2      1.1153182E+06         -5.24970367016E-06      
  3      2.5384265E+05         -1.86218447123E-05      
  4      7.1915285E+04         -6.12636343053E-05      
  5      2.3470181E+04         -1.92231342256E-04      
  6      8.4774918E+03         -5.67490230443E-04      
  7      3.3083908E+03         -1.56692422332E-03      
  8      1.3726054E+03         -3.98743831684E-03      
  9      5.9822007E+02         -9.04399321435E-03      
 10      2.7138602E+02         -1.71151234197E-02      
 11      1.2697795E+02         -2.19034282733E-02      
 12      6.0222065E+01         -6.26676755321E-04      
 13      2.8018582E+01          7.99926689497E-02      
 14      1.3517522E+01          1.41328096999E-01      
 15      6.3094060E+00         -1.67160055272E-02      
 16      2.9045340E+00         -2.86255258459E-01      
 17      1.2875560E+00         -3.23018100921E-01      
 18      1.6773200E-01          6.00935831622E-01      
S   1
  1      3.3655200E-01          1.0000000        
S   1
  1      7.1069000E-02          1.0000000        
P   11
  1      6.9795982E+03          7.66802204446E-04      
  2      1.6541648E+03          4.70243644634E-03      
  3      5.3602865E+02          2.32197535029E-02      
  4      2.0353713E+02          8.51642440306E-02      
  5      8.5237530E+01          2.25875590009E-01      
  6      3.7841962E+01          3.90351184435E-01      
  7      1.7406512E+01          3.51154351728E-01      
  8      7.8814920E+00          1.04166693689E-01      
  9      3.5332130E+00          3.59354535042E-03      
 10      1.5214730E+00          1.84765215960E-03      
 11      1.9909300E-01          1.81263628742E-04      
P   11
  1      6.9795982E+03         -2.96535784721E-04      
  2      1.6541648E+03         -1.83096518293E-03      
  3      5.3602865E+02         -9.11569400393E-03      
  4      2.0353713E+02         -3.43996115711E-02      
  5      8.5237530E+01         -9.50150852360E-02      
  6      3.7841962E+01         -1.75795778233E-01      
  7      1.7406512E+01         -1.42201859722E-01      
  8      7.8814920E+00          1.93428198459E-01      
  9      3.5332130E+00          5.27453031966E-01      
 10      1.5214730E+00          3.90625244814E-01      
 11      1.9909300E-01         -2.99751917407E-03      
P   11
  1      6.9795982E+03          5.81900216433E-05      
  2      1.6541648E+03          3.57999014816E-04      
  3      5.3602865E+02          1.79353429018E-03      
  4      2.0353713E+02          6.74848373574E-03      
  5      8.5237530E+01          1.88600218804E-02      
  6      3.7841962E+01          3.48226507437E-02      
  7      1.7406512E+01          2.83562495622E-02      
  8      7.8814920E+00         -4.85594033903E-02      
  9      3.5332130E+00         -1.24452048712E-01      
 10      1.5214730E+00         -1.17983715801E-01      
 11      1.9909300E-01          5.53511084827E-01      
P   1
  1      5.6270400E-01          1.0000000        
P   1
  1      6.7031000E-02          1.0000000        
D   7
  1      2.8223911E+02          1.91622463068E-03      
  2      8.4549957E+01          1.52961507677E-02      
  3      3.2073656E+01          6.59015287494E-02      
  4      1.3497495E+01          1.82860842789E-01      
  5      5.9585500E+00          3.21362748868E-01      
  6      2.6107880E+00          3.71738910431E-01      
  7      1.1039870E+00          2.78005776730E-01      
D   1
  1      4.2404900E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      3.4580000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: As
data:
ARSENIC
S   18
  1      8.4823396E+06          4.56436310709E-05      
  2      1.2701509E+06          1.61173127877E-04      
  3      2.8905696E+05          5.59514785654E-04      
  4      8.1879849E+04          1.80548777270E-03      
  5      2.6716564E+04          5.57823312404E-03      
  6      9.6475842E+03          1.61897877925E-02      
  7      3.7641195E+03          4.35779692537E-02      
  8      1.5615656E+03          1.05482747336E-01      
  9      6.8081467E+02          2.16113938103E-01      
 10      3.0924119E+02          3.33012051491E-01      
 11      1.4525736E+02          3.05101799797E-01      
 12      6.9739048E+01          1.12030152485E-01      
 13      3.1770325E+01          7.46403720173E-03      
 14      1.5391757E+01          3.07470533085E-04      
 15      7.3415260E+00         -1.43994182868E-04      
 16      3.3237160E+00          2.04214404927E-05      
 17      1.4858670E+00         -3.34591868697E-05      
 18      2.1150000E-01         -8.54857984981E-06      
S   18
  1      8.4823396E+06         -1.46387844293E-05      
  2      1.2701509E+06         -5.18451092902E-05      
  3      2.8905696E+05         -1.80696413758E-04      
  4      8.1879849E+04         -5.84493988176E-04      
  5      2.6716564E+04         -1.81750422695E-03      
  6      9.6475842E+03         -5.31049276428E-03      
  7      3.7641195E+03         -1.46229701200E-02      
  8      1.5615656E+03         -3.68309206769E-02      
  9      6.8081467E+02         -8.32649306949E-02      
 10      3.0924119E+02         -1.53842786418E-01      
 11      1.4525736E+02         -1.98298091047E-01      
 12      6.9739048E+01         -3.42432973044E-02      
 13      3.1770325E+01          4.37529801741E-01      
 14      1.5391757E+01          5.58606284015E-01      
 15      7.3415260E+00          1.55528269657E-01      
 16      3.3237160E+00          4.99430777443E-03      
 17      1.4858670E+00          1.67741493552E-03      
 18      2.1150000E-01          2.28195431683E-04      
S   18
  1      8.4823396E+06          5.72275621284E-06      
  2      1.2701509E+06          2.02742488919E-05      
  3      2.8905696E+05          7.07053471195E-05      
  4      8.1879849E+04          2.28736584225E-04      
  5      2.6716564E+04          7.12032402967E-04      
  6      9.6475842E+03          2.08150975952E-03      
  7      3.7641195E+03          5.75100306693E-03      
  8      1.5615656E+03          1.45516553623E-02      
  9      6.8081467E+02          3.33476041697E-02      
 10      3.0924119E+02          6.31236105035E-02      
 11      1.4525736E+02          8.56585209231E-02      
 12      6.9739048E+01          1.47641473011E-02      
 13      3.1770325E+01         -2.62024293214E-01      
 14      1.5391757E+01         -5.01835818097E-01      
 15      7.3415260E+00         -1.95433887381E-02      
 16      3.3237160E+00          7.22973064060E-01      
 17      1.4858670E+00          4.93677134175E-01      
 18      2.1150000E-01         -8.77562860520E-03      
S   18
  1      8.4823396E+06         -1.58831990072E-06      
  2      1.2701509E+06         -5.62871999190E-06      
  3      2.8905696E+05         -1.96219110826E-05      
  4      8.1879849E+04         -6.35298728284E-05      
  5      2.6716564E+04         -1.97563084982E-04      
  6      9.6475842E+03         -5.78492585467E-04      
  7      3.7641195E+03         -1.59583400409E-03      
  8      1.5615656E+03         -4.05113374104E-03      
  9      6.8081467E+02         -9.27036347856E-03      
 10      3.0924119E+02         -1.76940277932E-02      
 11      1.4525736E+02         -2.39899912755E-02      
 12      6.9739048E+01         -4.48122214164E-03      
 13      3.1770325E+01          7.82707491754E-02      
 14      1.5391757E+01          1.55759994726E-01      
 15      7.3415260E+00          4.07909498221E-03      
 16      3.3237160E+00         -3.03636034848E-01      
 17      1.4858670E+00         -3.70766506634E-01      
 18      2.1150000E-01          6.30862840575E-01      
S   1
  1      4.2108600E-01          1.0000000        
S   1
  1      8.8974000E-02          1.0000000        
P   11
  1      7.4238614E+03          7.92788299512E-04      
  2      1.7595166E+03          4.78396828801E-03      
  3      5.7022916E+02          2.35131168302E-02      
  4      2.1657997E+02          8.60057735117E-02      
  5      9.0734252E+01          2.27658754206E-01      
  6      4.0308791E+01          3.91796987579E-01      
  7      1.8555502E+01          3.48933683199E-01      
  8      8.3965430E+00          1.01825969098E-01      
  9      3.7673670E+00          3.26887608772E-03      
 10      1.6297010E+00          1.77371147188E-03      
 11      2.2250300E-01          2.14186126396E-04      
P   11
  1      7.4238614E+03         -3.11210823961E-04      
  2      1.7595166E+03         -1.89132796335E-03      
  3      5.7022916E+02         -9.37263213788E-03      
  4      2.1657997E+02         -3.52929391282E-02      
  5      9.0734252E+01         -9.73188809056E-02      
  6      4.0308791E+01         -1.79531173794E-01      
  7      1.8555502E+01         -1.41499100985E-01      
  8      8.3965430E+00          2.04327409445E-01      
  9      3.7673670E+00          5.37678192843E-01      
 10      1.6297010E+00          3.78600985087E-01      
 11      2.2250300E-01         -4.67299784206E-03      
P   11
  1      7.4238614E+03          6.87194169277E-05      
  2      1.7595166E+03          4.18492486349E-04      
  3      5.7022916E+02          2.07262816931E-03      
  4      2.1657997E+02          7.84481059727E-03      
  5      9.0734252E+01          2.16886343313E-02      
  6      4.0308791E+01          4.05163482095E-02      
  7      1.8555502E+01          3.08517813855E-02      
  8      8.3965430E+00         -5.62115907932E-02      
  9      3.7673670E+00         -1.51102655609E-01      
 10      1.6297010E+00         -1.18979558451E-01      
 11      2.2250300E-01          5.48711216990E-01      
P   1
  1      5.6826300E-01          1.0000000        
P   1
  1      8.0405000E-02          1.0000000        
D   7
  1      3.2101961E+02          1.77827768768E-03      
  2      9.6249305E+01          1.43336635235E-02      
  3      3.6644963E+01          6.27702965265E-02      
  4      1.5493965E+01          1.77524000864E-01      
  5      6.8911380E+00          3.19553867260E-01      
  6      3.0548310E+00          3.76080696033E-01      
  7      1.3142410E+00          2.77841564656E-01      
D   1
  1      5.1343000E-01          1.0000000        
D   1
  1      1.8770000E-01          1.0000000        
F   1
  1      4.1580000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Se
data:
SELENIUM
S   18
  1      9.5636000E+06          4.61249012701E-05      
  2      1.4321000E+06          1.59801439295E-04      
  3      3.2591000E+05          5.45377996737E-04      
  4      9.2312000E+04          1.73387146428E-03      
  5      3.0116000E+04          5.30255756094E-03      
  6      1.0872000E+04          1.52957053660E-02      
  7      4.2401000E+03          4.10844752420E-02      
  8      1.7584000E+03          9.97104955400E-02      
  9      7.6659000E+02          2.06263310416E-01      
 10      3.4843000E+02          3.25229169825E-01      
 11      1.6403000E+02          3.13057677125E-01      
 12      7.9142000E+01          1.28025771684E-01      
 13      3.5524000E+01          1.08768634093E-02      
 14      1.7305000E+01         -3.14790926465E-04      
 15      8.3784000E+00          1.49472853191E-04      
 16      3.7405000E+00         -1.11706581970E-04      
 17      1.6890000E+00          1.90654101604E-05      
 18      2.5520000E-01          7.80587353579E-06      
S   18
  1      9.5636000E+06         -1.48611264642E-05      
  2      1.4321000E+06         -5.16404961386E-05      
  3      3.2591000E+05         -1.76985374816E-04      
  4      9.2312000E+04         -5.64020209841E-04      
  5      3.0116000E+04         -1.73654870984E-03      
  6      1.0872000E+04         -5.03952015937E-03      
  7      4.2401000E+03         -1.38414200266E-02      
  8      1.7584000E+03         -3.48501180220E-02      
  9      7.6659000E+02         -7.92247934535E-02      
 10      3.4843000E+02         -1.48055582318E-01      
 11      1.6403000E+02         -1.98789684479E-01      
 12      7.9142000E+01         -5.67202433890E-02      
 13      3.5524000E+01          4.06637376441E-01      
 14      1.7305000E+01          5.69861290078E-01      
 15      8.3784000E+00          1.81025429502E-01      
 16      3.7405000E+00          8.19294524699E-03      
 17      1.6890000E+00          1.37210140307E-03      
 18      2.5520000E-01          1.49587464246E-04      
S   18
  1      9.5636000E+06          5.86968357612E-06      
  2      1.4321000E+06          2.04010565370E-05      
  3      3.2591000E+05          6.99771078503E-05      
  4      9.2312000E+04          2.22968434438E-04      
  5      3.0116000E+04          6.87550530821E-04      
  6      1.0872000E+04          1.99500916240E-03      
  7      4.2401000E+03          5.50185746561E-03      
  8      1.7584000E+03          1.38983437282E-02      
  9      7.6659000E+02          3.20533360640E-02      
 10      3.4843000E+02          6.11745588839E-02      
 11      1.6403000E+02          8.65927644411E-02      
 12      7.9142000E+01          2.50424322042E-02      
 13      3.5524000E+01         -2.41597948067E-01      
 14      1.7305000E+01         -5.07121192330E-01      
 15      8.3784000E+00         -7.01149508045E-02      
 16      3.7405000E+00          7.12720263201E-01      
 17      1.6890000E+00          5.23892768389E-01      
 18      2.5520000E-01         -9.06384395301E-03      
S   18
  1      9.5636000E+06         -1.72363204517E-06      
  2      1.4321000E+06         -5.99258634086E-06      
  3      3.2591000E+05         -2.05469575892E-05      
  4      9.2312000E+04         -6.55219986099E-05      
  5      3.0116000E+04         -2.01844014980E-04      
  6      1.0872000E+04         -5.86638819596E-04      
  7      4.2401000E+03         -1.61530785342E-03      
  8      1.7584000E+03         -4.09384240953E-03      
  9      7.6659000E+02         -9.42741492578E-03      
 10      3.4843000E+02         -1.81410758812E-02      
 11      1.6403000E+02         -2.56621648068E-02      
 12      7.9142000E+01         -7.82037242129E-03      
 13      3.5524000E+01          7.63699127038E-02      
 14      1.7305000E+01          1.66651693100E-01      
 15      8.3784000E+00          2.30798697816E-02      
 16      3.7405000E+00         -3.18294609866E-01      
 17      1.6890000E+00         -4.10899919269E-01      
 18      2.5520000E-01          6.57982749050E-01      
S   1
  1      5.0927000E-01          1.0000000        
S   1
  1      1.0651000E-01          1.0000000        
P   11
  1      8.0043000E+03          8.02419872764E-04      
  2      1.8969000E+03          4.75166335224E-03      
  3      6.1471000E+02          2.32604235017E-02      
  4      2.3350000E+02          8.50668881044E-02      
  5      9.7856000E+01          2.25852367613E-01      
  6      4.3514000E+01          3.90512806053E-01      
  7      2.0063000E+01          3.50323067186E-01      
  8      9.1127000E+00          1.04007217383E-01      
  9      4.1063000E+00          3.57858550102E-03      
 10      1.7949000E+00          1.72347990111E-03      
 11      2.4615000E-01          2.05756983790E-04      
P   11
  1      8.0043000E+03         -3.19621537343E-04      
  2      1.8969000E+03         -1.90588729347E-03      
  3      6.1471000E+02         -9.40951104689E-03      
  4      2.3350000E+02         -3.54142133450E-02      
  5      9.7856000E+01         -9.80037557546E-02      
  6      4.3514000E+01         -1.81591459206E-01      
  7      2.0063000E+01         -1.44711583837E-01      
  8      9.1127000E+00          2.03234549166E-01      
  9      4.1063000E+00          5.41983713310E-01      
 10      1.7949000E+00          3.76053294848E-01      
 11      2.4615000E-01         -4.46087185134E-03      
P   11
  1      8.0043000E+03          7.69991404112E-05      
  2      1.8969000E+03          4.61231703401E-04      
  3      6.1471000E+02          2.26893802483E-03      
  4      2.3350000E+02          8.61501179099E-03      
  5      9.7856000E+01          2.38099920218E-02      
  6      4.3514000E+01          4.49771280792E-02      
  7      2.0063000E+01          3.40281068382E-02      
  8      9.1127000E+00         -6.07247441440E-02      
  9      4.1063000E+00         -1.71691792510E-01      
 10      1.7949000E+00         -1.23714969840E-01      
 11      2.4615000E-01          5.67376401146E-01      
P   1
  1      6.2432000E-01          1.0000000        
P   1
  1      8.8917000E-02          1.0000000        
D   7
  1      3.6185000E+02          1.66488098752E-03      
  2      1.0855000E+02          1.35303002260E-02      
  3      4.1433000E+01          6.01694477814E-02      
  4      1.7579000E+01          1.73132617850E-01      
  5      7.8627000E+00          3.18150670068E-01      
  6      3.5180000E+00          3.79851517212E-01      
  7      1.5348000E+00          2.77312006881E-01      
D   1
  1      6.0813000E-01          1.0000000        
D   1
  1      2.2200000E-01          1.0000000        
F   1
  1      4.6200000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Br
data:
BROMINE
S   18
  1      1.0639000E+07          4.70496579460E-05      
  2      1.5934000E+06          1.60243268834E-04      
  3      3.6261000E+05          5.38438809279E-04      
  4      1.0270000E+05          1.68793414782E-03      
  5      3.3501000E+04          5.11060060500E-03      
  6      1.2093000E+04          1.46439018276E-02      
  7      4.7159000E+03          3.92116011749E-02      
  8      1.9556000E+03          9.52618573352E-02      
  9      8.5261000E+02          1.98445836582E-01      
 10      3.8767000E+02          3.18544238823E-01      
 11      1.8268000E+02          3.18783956186E-01      
 12      8.8245000E+01          1.41158203499E-01      
 13      3.9263000E+01          1.38788826351E-02      
 14      1.9234000E+01         -8.39753224098E-04      
 15      9.4057000E+00          3.96696922507E-04      
 16      4.1601000E+00         -2.21901768029E-04      
 17      1.8995000E+00          6.75367547699E-05      
 18      3.0114000E-01          2.19742008055E-05      
S   18
  1      1.0639000E+07         -1.52269240732E-05      
  2      1.5934000E+06         -5.20171785054E-05      
  3      3.6261000E+05         -1.75554312872E-04      
  4      1.0270000E+05         -5.51709859519E-04      
  5      3.3501000E+04         -1.68203121380E-03      
  6      1.2093000E+04         -4.84704152724E-03      
  7      4.7159000E+03         -1.32652699307E-02      
  8      1.9556000E+03         -3.33621940539E-02      
  9      8.5261000E+02         -7.61115179993E-02      
 10      3.8767000E+02         -1.43559644475E-01      
 11      1.8268000E+02         -1.98640157995E-01      
 12      8.8245000E+01         -7.32107399375E-02      
 13      3.9263000E+01          3.80750565041E-01      
 14      1.9234000E+01          5.76137002648E-01      
 15      9.4057000E+00          2.03163441083E-01      
 16      4.1601000E+00          1.12005678183E-02      
 17      1.8995000E+00          1.04148691942E-03      
 18      3.0114000E-01          7.11666693110E-05      
S   18
  1      1.0639000E+07          6.07422905733E-06      
  2      1.5934000E+06          2.07540518740E-05      
  3      3.6261000E+05          7.01109065677E-05      
  4      1.0270000E+05          2.20261747724E-04      
  5      3.3501000E+04          6.72773000405E-04      
  6      1.2093000E+04          1.93758267797E-03      
  7      4.7159000E+03          5.32701022818E-03      
  8      1.9556000E+03          1.34294392696E-02      
  9      8.5261000E+02          3.10980303350E-02      
 10      3.8767000E+02          5.97685054612E-02      
 11      1.8268000E+02          8.72447043984E-02      
 12      8.8245000E+01          3.27392892505E-02      
 13      3.9263000E+01         -2.25602364653E-01      
 14      1.9234000E+01         -5.09369319440E-01      
 15      9.4057000E+00         -1.10237485827E-01      
 16      4.1601000E+00          7.02139678828E-01      
 17      1.8995000E+00          5.47293170261E-01      
 18      3.0114000E-01         -8.97063834778E-03      
S   18
  1      1.0639000E+07         -1.86699348551E-06      
  2      1.5934000E+06         -6.38097074893E-06      
  3      3.6261000E+05         -2.15478346603E-05      
  4      1.0270000E+05         -6.77501816159E-05      
  5      3.3501000E+04         -2.06732441512E-04      
  6      1.2093000E+04         -5.96377264373E-04      
  7      4.7159000E+03         -1.63702368459E-03      
  8      1.9556000E+03         -4.14060261338E-03      
  9      8.5261000E+02         -9.57344340651E-03      
 10      3.8767000E+02         -1.85513779690E-02      
 11      1.8268000E+02         -2.70659952257E-02      
 12      8.8245000E+01         -1.06029696314E-02      
 13      3.9263000E+01          7.47023490836E-02      
 14      1.9234000E+01          1.75322481480E-01      
 15      9.4057000E+00          3.98166429852E-02      
 16      4.1601000E+00         -3.30429997622E-01      
 17      1.8995000E+00         -4.45920668317E-01      
 18      3.0114000E-01          6.80833639089E-01      
S   1
  1      6.0472000E-01          1.0000000        
S   1
  1      1.2515000E-01          1.0000000        
P   11
  1      8.6765000E+03          8.04729686707E-04      
  2      2.0559000E+03          4.66800608963E-03      
  3      6.6623000E+02          2.27569889706E-02      
  4      2.5310000E+02          8.32781793394E-02      
  5      1.0612000E+02          2.22237930056E-01      
  6      4.7242000E+01          3.87780475453E-01      
  7      2.1825000E+01          3.53455267778E-01      
  8      9.9684000E+00          1.08524688132E-01      
  9      4.5171000E+00          4.22747711868E-03      
 10      1.9982000E+00          1.69576537497E-03      
 11      2.8145000E-01          1.98056529564E-04      
P   11
  1      8.6765000E+03         -3.25054757119E-04      
  2      2.0559000E+03         -1.89811333827E-03      
  3      6.6623000E+02         -9.33622455296E-03      
  4      2.5310000E+02         -3.51353675784E-02      
  5      1.0612000E+02         -9.77904412563E-02      
  6      4.7242000E+01         -1.82686109548E-01      
  7      2.1825000E+01         -1.49870136020E-01      
  8      9.9684000E+00          1.95940300633E-01      
  9      4.5171000E+00          5.43365369124E-01      
 10      1.9982000E+00          3.79130184462E-01      
 11      2.8145000E-01         -4.03664776369E-03      
P   11
  1      8.6765000E+03          8.38435576481E-05      
  2      2.0559000E+03          4.92212337438E-04      
  3      6.6623000E+02          2.41002168244E-03      
  4      2.5310000E+02          9.16170164839E-03      
  5      1.0612000E+02          2.54374316327E-02      
  6      4.7242000E+01          4.85650053584E-02      
  7      2.1825000E+01          3.76939163510E-02      
  8      9.9684000E+00         -6.30857298340E-02      
  9      4.5171000E+00         -1.87896077877E-01      
 10      1.9982000E+00         -1.31854682362E-01      
 11      2.8145000E-01          5.72346388438E-01      
P   1
  1      7.0988000E-01          1.0000000        
P   1
  1      1.0204000E-01          1.0000000        
D   7
  1      4.0383000E+02          1.57820799009E-03      
  2      1.2117000E+02          1.29051688594E-02      
  3      4.6345000E+01          5.81342981120E-02      
  4      1.9721000E+01          1.69694833486E-01      
  5      8.8624000E+00          3.17171495048E-01      
  6      3.9962000E+00          3.83075011552E-01      
  7      1.7636000E+00          2.76410256623E-01      
D   1
  1      7.0619000E-01          1.0000000        
D   1
  1      2.6390000E-01          1.0000000        
F   1
  1      5.5150000E-01          1.0000000


name: cc-pVTZ(pt/sf/lc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   18
  1      1.1718113E+07          4.83121548228E-05      
  2      1.7546044E+06          1.62065080250E-04      
  3      3.9928132E+05          5.36702444404E-04      
  4      1.1308457E+05          1.66002715511E-03      
  5      3.6885925E+04          4.97768037908E-03      
  6      1.3312209E+04          1.41705072115E-02      
  7      5.1899883E+03          3.78215964080E-02      
  8      2.1516597E+03          9.18908614300E-02      
  9      9.3803251E+02          1.92366193988E-01      
 10      4.2655732E+02          3.13006324958E-01      
 11      2.0106660E+02          3.22811035622E-01      
 12      9.7097605E+01          1.51641399069E-01      
 13      4.2998724E+01          1.64510208333E-02      
 14      2.1177075E+01         -1.25865143275E-03      
 15      1.0426752E+01          5.93355562688E-04      
 16      4.5850080E+00         -3.10728275304E-04      
 17      2.1176030E+00          1.10227792800E-04      
 18      3.4922500E-01          3.33593159674E-05      
S   18
  1      1.1718113E+07         -1.57038916815E-05      
  2      1.7546044E+06         -5.28416406846E-05      
  3      3.9928132E+05         -1.75789254278E-04      
  4      1.1308457E+05         -5.45157998161E-04      
  5      3.6885925E+04         -1.64628340408E-03      
  6      1.3312209E+04         -4.71239657694E-03      
  7      5.1899883E+03         -1.28498277267E-02      
  8      2.1516597E+03         -3.22698571756E-02      
  9      9.3803251E+02         -7.37736425518E-02      
 10      4.2655732E+02         -1.40144344213E-01      
 11      2.0106660E+02         -1.98252801786E-01      
 12      9.7097605E+01         -8.53539437744E-02      
 13      4.2998724E+01          3.59443649679E-01      
 14      2.1177075E+01          5.79358785969E-01      
 15      1.0426752E+01          2.22019563041E-01      
 16      4.5850080E+00          1.39171871707E-02      
 17      2.1176030E+00          7.20656974736E-04      
 18      3.4922500E-01          2.90161465398E-06      
S   18
  1      1.1718113E+07          6.32449283498E-06      
  2      1.7546044E+06          2.12842990967E-05      
  3      3.9928132E+05          7.08820856184E-05      
  4      1.1308457E+05          2.19722859281E-04      
  5      3.6885925E+04          6.64905567082E-04      
  6      1.3312209E+04          1.90159793101E-03      
  7      5.1899883E+03          5.21081161789E-03      
  8      2.1516597E+03          1.31087756050E-02      
  9      9.3803251E+02          3.04297488103E-02      
 10      4.2655732E+02          5.88076318045E-02      
 11      2.0106660E+02          8.77914532376E-02      
 12      9.7097605E+01          3.85554829202E-02      
 13      4.2998724E+01         -2.13133498560E-01      
 14      2.1177075E+01         -5.10324462945E-01      
 15      1.0426752E+01         -1.42489543924E-01      
 16      4.5850080E+00          6.92532383113E-01      
 17      2.1176030E+00          5.65418556181E-01      
 18      3.4922500E-01         -8.60561179071E-03      
S   18
  1      1.1718113E+07         -2.01908740380E-06      
  2      1.7546044E+06         -6.79706466539E-06      
  3      3.9928132E+05         -2.26275301296E-05      
  4      1.1308457E+05         -7.01988669861E-05      
  5      3.6885925E+04         -2.12219734089E-04      
  6      1.3312209E+04         -6.07953589365E-04      
  7      5.1899883E+03         -1.66326358235E-03      
  8      2.1516597E+03         -4.19820968353E-03      
  9      9.3803251E+02         -9.73003210164E-03      
 10      4.2655732E+02         -1.89593934302E-02      
 11      2.0106660E+02         -2.82927630273E-02      
 12      9.7097605E+01         -1.29141144784E-02      
 13      4.2998724E+01          7.33882667226E-02      
 14      2.1177075E+01          1.82579126571E-01      
 15      1.0426752E+01          5.45336234587E-02      
 16      4.5850080E+00         -3.41122171781E-01      
 17      2.1176030E+00         -4.76701929510E-01      
 18      3.4922500E-01          7.00129329188E-01      
S   1
  1      7.0705700E-01          1.0000000        
S   1
  1      1.4482100E-01          1.0000000        
P   11
  1      9.3663090E+03          8.10101714505E-04      
  2      2.2195543E+03          4.60230806371E-03      
  3      7.1945288E+02          2.23221957238E-02      
  4      2.7346446E+02          8.16405387468E-02      
  5      1.1475225E+02          2.18759374003E-01      
  6      5.1155569E+01          3.84925939063E-01      
  7      2.3682676E+01          3.56323945560E-01      
  8      1.0875484E+01          1.13031248142E-01      
  9      4.9551310E+00          4.91487546791E-03      
 10      2.2172670E+00          1.66360266086E-03      
 11      3.2215400E-01          2.04754319958E-04      
P   11
  1      9.3663090E+03         -3.31725967370E-04      
  2      2.2195543E+03         -1.89663033871E-03      
  3      7.1945288E+02         -9.28483488903E-03      
  4      2.7346446E+02         -3.48985814031E-02      
  5      1.1475225E+02         -9.75819701949E-02      
  6      5.1155569E+01         -1.83670965818E-01      
  7      2.3682676E+01         -1.54882994191E-01      
  8      1.0875484E+01          1.88681648983E-01      
  9      4.9551310E+00          5.44518784567E-01      
 10      2.2172670E+00          3.82537730773E-01      
 11      3.2215400E-01         -4.43823536118E-03      
P   11
  1      9.3663090E+03          8.98615332814E-05      
  2      2.2195543E+03          5.16749749469E-04      
  3      7.1945288E+02          2.51695812614E-03      
  4      2.7346446E+02          9.56394444251E-03      
  5      1.1475225E+02          2.66636905405E-02      
  6      5.1155569E+01          5.13709074980E-02      
  7      2.3682676E+01          4.09435791476E-02      
  8      1.0875484E+01         -6.44089014374E-02      
  9      4.9551310E+00         -2.01169904415E-01      
 10      2.2172670E+00         -1.38997718602E-01      
 11      3.2215400E-01          5.72477469807E-01      
P   1
  1      8.0641000E-01          1.0000000        
P   1
  1      1.1761900E-01          1.0000000        
D   7
  1      4.4616133E+02          1.51552869205E-03      
  2      1.3396477E+02          1.24326689804E-02      
  3      5.1345907E+01          5.65532536936E-02      
  4      2.1916906E+01          1.66911553797E-01      
  5      9.8937250E+00          3.16320087142E-01      
  6      4.4925270E+00          3.85767708421E-01      
  7      2.0022930E+00          2.75372736503E-01      
D   1
  1      8.0840900E-01          1.0000000        
D   1
  1      3.0060000E-01          1.0000000        
F   1
  1      6.6220000E-01          1.0000000


name: cc-pVTZ+
description: cc-pVTZ basis set augmented with diffuse functions from 6-31+G basis set.
elt: S
data:
SULFUR
S   15
  1 374100.0000000              0.542140E-04     
  2  56050.0000000              0.420855E-03     
  3  12760.0000000              0.220698E-02     
  4   3615.0000000              0.919258E-02     
  5   1183.0000000              0.321123E-01     
  6    428.8000000              0.946683E-01     
  7    167.8000000              0.223630E+00     
  8     69.4700000              0.374393E+00     
  9     29.8400000              0.329108E+00     
 10     12.7200000              0.847038E-01     
 11      5.2440000              0.440851E-03     
 12      2.2190000              0.164827E-02     
 13      0.7767000             -0.622332E-03     
 14      0.3490000              0.301306E-03     
 15      0.1322000             -0.841290E-04     
S   15
  1 374100.0000000             -0.149837E-04     
  2  56050.0000000             -0.116198E-03     
  3  12760.0000000             -0.611583E-03     
  4   3615.0000000             -0.255370E-02     
  5   1183.0000000             -0.908708E-02     
  6    428.8000000             -0.277045E-01     
  7    167.8000000             -0.720020E-01     
  8     69.4700000             -0.146439E+00     
  9     29.8400000             -0.195150E+00     
 10     12.7200000              0.819193E-02     
 11      5.2440000              0.516601E+00     
 12      2.2190000              0.542178E+00     
 13      0.7767000              0.688430E-01     
 14      0.3490000             -0.918072E-02     
 15      0.1322000              0.226832E-02     
S   15
  1 374100.0000000              0.435066E-05     
  2  56050.0000000              0.337140E-04     
  3  12760.0000000              0.177674E-03     
  4   3615.0000000              0.741116E-03     
  5   1183.0000000              0.264591E-02     
  6    428.8000000              0.807487E-02     
  7    167.8000000              0.212276E-01     
  8     69.4700000              0.438323E-01     
  9     29.8400000              0.612716E-01     
 10     12.7200000             -0.361510E-02     
 11      5.2440000             -0.204510E+00     
 12      2.2190000             -0.381871E+00     
 13      0.7767000              0.826844E-01     
 14      0.3490000              0.714147E+00     
 15      0.1322000              0.393791E+00     
S   1
  1      0.7767000              1.0000000        
S   1
  1      0.1322000              1.0000000        
P   9
  1    574.4000000              0.242264E-02     
  2    135.8000000              0.192796E-01     
  3     43.1900000              0.885401E-01     
  4     15.8700000              0.254654E+00     
  5      6.2080000              0.433984E+00     
  6      2.4830000              0.354953E+00     
  7      0.8688000              0.618941E-01     
  8      0.3229000             -0.502977E-02     
  9      0.1098000              0.209813E-02     
P   9
  1    574.4000000             -0.620102E-03     
  2    135.8000000             -0.493882E-02     
  3     43.1900000             -0.232647E-01     
  4     15.8700000             -0.685195E-01     
  5      6.2080000             -0.123896E+00     
  6      2.4830000             -0.969499E-01     
  7      0.8688000              0.228215E+00     
  8      0.3229000              0.569394E+00     
  9      0.1098000              0.366302E+00     
P   1
  1      0.8688000              1.0000000        
P   1
  1      0.1098000              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      0.2690000              1.0000000        
D   1
  1      0.8190000              1.0000000        
F   1
  1      0.5570000              1.0000000


name: cc-pVTZ+
description: cc-pVTZ basis set augmented with diffuse functions from 6-31+G basis set.
elt: Cl
data:
CHLORINE
S   15
  1 456100.0000000              0.492970E-04     
  2  68330.0000000              0.383029E-03     
  3  15550.0000000              0.200854E-02     
  4   4405.0000000              0.838558E-02     
  5   1439.0000000              0.294703E-01     
  6    520.4000000              0.878325E-01     
  7    203.1000000              0.211473E+00     
  8     83.9600000              0.365364E+00     
  9     36.2000000              0.340884E+00     
 10     15.8300000              0.102133E+00     
 11      6.3340000              0.311675E-02     
 12      2.6940000              0.105751E-02     
 13      0.9768000             -0.378000E-03     
 14      0.4313000              0.156136E-03     
 15      0.1625000             -0.514126E-04     
S   15
  1 456100.0000000             -0.138304E-04     
  2  68330.0000000             -0.107279E-03     
  3  15550.0000000             -0.565083E-03     
  4   4405.0000000             -0.236135E-02     
  5   1439.0000000             -0.845886E-02     
  6    520.4000000             -0.259638E-01     
  7    203.1000000             -0.686362E-01     
  8     83.9600000             -0.141874E+00     
  9     36.2000000             -0.199319E+00     
 10     15.8300000             -0.195662E-01     
 11      6.3340000              0.499741E+00     
 12      2.6940000              0.563736E+00     
 13      0.9768000              0.790325E-01     
 14      0.4313000             -0.835091E-02     
 15      0.1625000              0.232456E-02     
S   15
  1 456100.0000000              0.418546E-05     
  2  68330.0000000              0.324395E-04     
  3  15550.0000000              0.171105E-03     
  4   4405.0000000              0.714176E-03     
  5   1439.0000000              0.256705E-02     
  6    520.4000000              0.788552E-02     
  7    203.1000000              0.210867E-01     
  8     83.9600000              0.442264E-01     
  9     36.2000000              0.651670E-01     
 10     15.8300000              0.603012E-02     
 11      6.3340000             -0.206495E+00     
 12      2.6940000             -0.405871E+00     
 13      0.9768000              0.759558E-01     
 14      0.4313000              0.725661E+00     
 15      0.1625000              0.394423E+00     
S   1
  1      0.9768000              1.0000000        
S   1
  1      0.1625000              1.0000000        
P   9
  1    663.3000000              0.240448E-02     
  2    156.8000000              0.192148E-01     
  3     49.9800000              0.885097E-01     
  4     18.4200000              0.256020E+00     
  5      7.2400000              0.436927E+00     
  6      2.9220000              0.350334E+00     
  7      1.0220000              0.585495E-01     
  8      0.3818000             -0.458423E-02     
  9      0.1301000              0.226970E-02     
P   9
  1    663.3000000             -0.652145E-03     
  2    156.8000000             -0.519445E-02     
  3     49.9800000             -0.246938E-01     
  4     18.4200000             -0.728167E-01     
  5      7.2400000             -0.134030E+00     
  6      2.9220000             -0.947742E-01     
  7      1.0220000              0.262289E+00     
  8      0.3818000              0.564667E+00     
  9      0.1301000              0.341250E+00     
P   1
  1      1.0220000              1.0000000        
P   1
  1      0.1301000              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      1.0460000              1.0000000        
D   1
  1      0.3440000              1.0000000        
F   1
  1      0.7060000              1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: H
data:
HYDROGEN
S   3
  1      3.3870000E+01          6.06858595771E-03      
  2      5.0950000E+00          4.53098965745E-02      
  3      1.1590000E+00          2.02826206672E-01      
S   1
  1      3.2580000E-01          1.0000000        
S   1
  1      1.0270000E-01          1.0000000        
P   1
  1      1.4070000E+00          1.0000000        
P   1
  1      3.8800000E-01          1.0000000        
D   1
  1      1.0570000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      2.3400000E+02          2.58822519272E-03      
  2      3.5160000E+01          1.95369509578E-02      
  3      7.9890000E+00          9.10073419405E-02      
  4      2.2120000E+00          2.72056506657E-01      
S   1
  1      6.6690000E-01          1.0000000        
S   1
  1      2.0890000E-01          1.0000000        
P   1
  1      3.0440000E+00          1.0000000        
P   1
  1      7.5800000E-01          1.0000000        
D   1
  1      1.9650000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: B
data:
BORON
S   8
  1      5.4730000E+03          5.56847577762E-04      
  2      8.2090000E+02          4.29915680360E-03      
  3      1.8680000E+02          2.19792140381E-02      
  4      5.2830000E+01          8.45083350809E-02      
  5      1.7080000E+01          2.38623471327E-01      
  6      5.9990000E+00          4.34998762575E-01      
  7      2.2080000E+00          3.41735888835E-01      
  8      2.4150000E-01         -9.53189494636E-03      
S   8
  1      5.4730000E+03         -1.12580135006E-04      
  2      8.2090000E+02         -8.70402331222E-04      
  3      1.8680000E+02         -4.49146964830E-03      
  4      5.2830000E+01         -1.77053623869E-02      
  5      1.7080000E+01         -5.36694108652E-02      
  6      5.9990000E+00         -1.19039284183E-01      
  7      2.2080000E+00         -1.65662351739E-01      
  8      2.4150000E-01          5.95993884939E-01      
S   1
  1      5.8790000E-01          1.0000000        
S   1
  1      8.6100000E-02          1.0000000        
P   3
  1      1.2050000E+01          1.31199691999E-02      
  2      2.6130000E+00          7.98844703602E-02      
  3      7.4750000E-01          2.77211667375E-01      
P   1
  1      2.3850000E-01          1.0000000        
P   1
  1      7.6980000E-02          1.0000000        
D   1
  1      6.6100000E-01          1.0000000        
D   1
  1      1.9900000E-01          1.0000000        
F   1
  1      4.9000000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: C
data:
CARBON
S   8
  1      8.2360000E+03          5.33281971165E-04      
  2      1.2350000E+03          4.11950286828E-03      
  3      2.8080000E+02          2.11304632337E-02      
  4      7.9270000E+01          8.19540594771E-02      
  5      2.5590000E+01          2.34924585464E-01      
  6      8.9970000E+00          4.34340234750E-01      
  7      3.3190000E+00          3.45805524021E-01      
  8      3.6430000E-01         -8.96209382437E-03      
S   8
  1      8.2360000E+03         -1.13987795730E-04      
  2      1.2350000E+03         -8.83152060716E-04      
  3      2.8080000E+02         -4.56263664563E-03      
  4      7.9270000E+01         -1.82109874692E-02      
  5      2.5590000E+01         -5.59477859339E-02      
  6      8.9970000E+00         -1.27284991589E-01      
  7      3.3190000E+00         -1.70625425725E-01      
  8      3.6430000E-01          6.00776784439E-01      
S   1
  1      9.0590000E-01          1.0000000        
S   1
  1      1.2850000E-01          1.0000000        
P   3
  1      1.8710000E+01          1.39361092067E-02      
  2      4.1330000E+00          8.64105499654E-02      
  3      1.2000000E+00          2.87303137582E-01      
P   1
  1      3.8270000E-01          1.0000000        
P   1
  1      1.2090000E-01          1.0000000        
D   1
  1      1.0970000E+00          1.0000000        
D   1
  1      3.1800000E-01          1.0000000        
F   1
  1      7.6100000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: N
data:
NITROGEN
S   8
  1      1.1420000E+04          5.25694502755E-04      
  2      1.7120000E+03          4.06099871459E-03      
  3      3.8930000E+02          2.08339891736E-02      
  4      1.1000000E+02          8.08685334383E-02      
  5      3.5570000E+01          2.33231214185E-01      
  6      1.2540000E+01          4.33448713095E-01      
  7      4.6440000E+00          3.47027751142E-01      
  8      5.1180000E-01         -8.48168196755E-03      
S   8
  1      1.1420000E+04         -1.16472762969E-04      
  2      1.7120000E+03         -9.03186242451E-04      
  3      3.8930000E+02         -4.66233389534E-03      
  4      1.1000000E+02         -1.86654573423E-02      
  5      3.5570000E+01         -5.76941497503E-02      
  6      1.2540000E+01         -1.32848092866E-01      
  7      4.6440000E+00         -1.73194086054E-01      
  8      5.1180000E-01          6.03926096038E-01      
S   1
  1      1.2930000E+00          1.0000000        
S   1
  1      1.7870000E-01          1.0000000        
P   3
  1      2.6630000E+01          1.45411590456E-02      
  2      5.9480000E+00          9.11823683044E-02      
  3      1.7420000E+00          2.94410616457E-01      
P   1
  1      5.5500000E-01          1.0000000        
P   1
  1      1.7250000E-01          1.0000000        
D   1
  1      1.6540000E+00          1.0000000        
D   1
  1      4.6900000E-01          1.0000000        
F   1
  1      1.0930000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: O
data:
OXYGEN
S   8
  1      1.5330000E+04          5.11478003985E-04      
  2      2.2990000E+03          3.94955606368E-03      
  3      5.2240000E+02          2.03171576177E-02      
  4      1.4730000E+02          7.93585223466E-02      
  5      4.7550000E+01          2.30885718201E-01      
  6      1.6760000E+01          4.32962255933E-01      
  7      6.2070000E+00          3.49671623945E-01      
  8      6.8820000E-01         -8.12468179682E-03      
S   8
  1      1.5330000E+04         -1.16270378360E-04      
  2      2.2990000E+03         -9.01794314811E-04      
  3      5.2240000E+02         -4.66373809346E-03      
  4      1.4730000E+02         -1.88147240284E-02      
  5      4.7550000E+01         -5.86417849636E-02      
  6      1.6760000E+01         -1.36757297622E-01      
  7      6.2070000E+00         -1.75490965492E-01      
  8      6.8820000E-01          6.04381558307E-01      
S   1
  1      1.7520000E+00          1.0000000        
S   1
  1      2.3840000E-01          1.0000000        
P   3
  1      3.4460000E+01          1.59236007852E-02      
  2      7.7490000E+00          9.96609864402E-02      
  3      2.2800000E+00          3.09522318630E-01      
P   1
  1      7.1560000E-01          1.0000000        
P   1
  1      2.1400000E-01          1.0000000        
D   1
  1      2.3140000E+00          1.0000000        
D   1
  1      6.4500000E-01          1.0000000        
F   1
  1      1.4280000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: F
data:
FLUORINE
S   8
  1      1.9500000E+04          5.11467876609E-04      
  2      2.9230000E+03          3.94844441233E-03      
  3      6.6450000E+02          2.02938987765E-02      
  4      1.8750000E+02          7.92337655118E-02      
  5      6.0620000E+01          2.30690215197E-01      
  6      2.1420000E+01          4.32648011062E-01      
  7      7.9500000E+00          3.49213254124E-01      
  8      8.8150000E-01         -7.85490019562E-03      
S   8
  1      1.9500000E+04         -1.18499725528E-04      
  2      2.9230000E+03         -9.19450986313E-04      
  3      6.6450000E+02         -4.74729440777E-03      
  4      1.8750000E+02         -1.91769263120E-02      
  5      6.0620000E+01         -5.98028822153E-02      
  6      2.1420000E+01         -1.40177102060E-01      
  7      7.9500000E+00         -1.76107989506E-01      
  8      8.8150000E-01          6.05031232883E-01      
S   1
  1      2.2570000E+00          1.0000000        
S   1
  1      3.0410000E-01          1.0000000        
P   3
  1      4.3880000E+01          1.67000408865E-02      
  2      9.9260000E+00          1.04528503801E-01      
  3      2.9300000E+00          3.17193881124E-01      
P   1
  1      9.1320000E-01          1.0000000        
P   1
  1      2.6720000E-01          1.0000000        
D   1
  1      3.1070000E+00          1.0000000        
D   1
  1      8.5500000E-01          1.0000000        
F   1
  1      1.9170000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Ne
data:
NEON
S   8
  1      2.4350000E+04          5.06857891128E-04      
  2      3.6500000E+03          3.91249891798E-03      
  3      8.2960000E+02          2.01126783990E-02      
  4      2.3400000E+02          7.86955350280E-02      
  5      7.5610000E+01          2.29991637401E-01      
  6      2.6730000E+01          4.32444870907E-01      
  7      9.9270000E+00          3.49709688410E-01      
  8      1.1020000E+00         -7.60032986872E-03      
S   8
  1      2.4350000E+04         -1.19184724592E-04      
  2      3.6500000E+03         -9.25072754775E-04      
  3      8.2960000E+02         -4.77457728570E-03      
  4      2.3400000E+02         -1.93485967530E-02      
  5      7.5610000E+01         -6.05595349286E-02      
  6      2.6730000E+01         -1.42720710562E-01      
  7      9.9270000E+00         -1.76851711883E-01      
  8      1.1020000E+00          6.05804557853E-01      
S   1
  1      2.8360000E+00          1.0000000        
S   1
  1      3.7820000E-01          1.0000000        
P   3
  1      5.4700000E+01          1.71989443496E-02      
  2      1.2430000E+01          1.07739955018E-01      
  3      3.6790000E+00          3.21608824364E-01      
P   1
  1      1.1430000E+00          1.0000000        
P   1
  1      3.3000000E-01          1.0000000        
D   1
  1      4.0140000E+00          1.0000000        
D   1
  1      1.0960000E+00          1.0000000        
F   1
  1      2.5440000E+00          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   13
  1      2.0550000E+05          6.93489817715E-05      
  2      3.0780000E+04          5.36586495078E-04      
  3      7.0060000E+03          2.80135446515E-03      
  4      1.9850000E+03          1.15977672548E-02      
  5      6.4910000E+02          4.01220129184E-02      
  6      2.3500000E+02          1.15542443636E-01      
  7      9.1620000E+01          2.61210295805E-01      
  8      3.7670000E+01          3.95671543301E-01      
  9      1.5910000E+01          2.83229195905E-01      
 10      5.8500000E+00          4.41132626591E-02      
 11      2.5420000E+00         -4.85113353866E-03      
 12      1.0570000E+00          2.58813765131E-03      
 13      1.4550000E-01          7.14693764362E-04      
S   13
  1      2.0550000E+05         -1.80822390701E-05      
  2      3.0780000E+04         -1.40162582317E-04      
  3      7.0060000E+03         -7.31752674513E-04      
  4      1.9850000E+03         -3.05588832407E-03      
  5      6.4910000E+02         -1.07203213709E-02      
  6      2.3500000E+02         -3.23976450863E-02      
  7      9.1620000E+01         -8.06512719987E-02      
  8      3.7670000E+01         -1.56929837213E-01      
  9      1.5910000E+01         -1.66785913388E-01      
 10      5.8500000E+00          1.29951980196E-01      
 11      2.5420000E+00          5.61985640649E-01      
 12      1.0570000E+00          4.33725555231E-01      
 13      1.4550000E-01         -1.10709594063E-02      
S   13
  1      2.0550000E+05          4.17599638798E-06      
  2      3.0780000E+04          3.23472616118E-05      
  3      7.0060000E+03          1.69082250721E-04      
  4      1.9850000E+03          7.05420232976E-04      
  5      6.4910000E+02          2.48250193428E-03      
  6      2.3500000E+02          7.50949816519E-03      
  7      9.1620000E+01          1.89007553166E-02      
  8      3.7670000E+01          3.73295606366E-02      
  9      1.5910000E+01          4.15093379874E-02      
 10      5.8500000E+00         -3.62246418572E-02      
 11      2.5420000E+00         -1.75946666070E-01      
 12      1.0570000E+00         -2.74768299859E-01      
 13      1.4550000E-01          6.52081475557E-01      
S   1
  1      2.9310000E-01          1.0000000        
S   1
  1      5.6500000E-02          1.0000000        
P   7
  1      4.4440000E+02          1.64938680671E-03      
  2      1.0510000E+02          1.31525615769E-02      
  3      3.3470000E+01          6.14134930962E-02      
  4      1.2330000E+01          1.88015013200E-01      
  5      4.8690000E+00          3.60274615720E-01      
  6      1.9610000E+00          4.07999010371E-01      
  7      1.8880000E-01          9.72385108256E-03      
P   7
  1      4.4440000E+02         -2.90017998929E-04      
  2      1.0510000E+02         -2.43660128091E-03      
  3      3.3470000E+01         -1.08904747734E-02      
  4      1.2330000E+01         -3.64265977175E-02      
  5      4.8690000E+00         -6.40031846011E-02      
  6      1.9610000E+00         -9.70445428227E-02      
  7      1.8880000E-01          5.02694782171E-01      
P   1
  1      7.8340000E-01          1.0000000        
P   1
  1      5.5570000E-02          1.0000000        
D   1
  1      3.3300000E-01          1.0000000        
D   1
  1      1.0900000E-01          1.0000000        
F   1
  1      2.4400000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: Si
data:
SILICON
S   13
  1      2.5490000E+05          6.40907270449E-05      
  2      3.8190000E+04          4.95749587960E-04      
  3      8.6900000E+03          2.58779287987E-03      
  4      2.4620000E+03          1.07239216450E-02      
  5      8.0480000E+02          3.72140288130E-02      
  6      2.9130000E+02          1.08052509519E-01      
  7      1.1360000E+02          2.48357991181E-01      
  8      4.6750000E+01          3.90206536340E-01      
  9      1.9820000E+01          3.00417294593E-01      
 10      7.7080000E+00          5.54360762491E-02      
 11      3.3400000E+00         -3.97958935523E-03      
 12      1.4020000E+00          2.55225966822E-03      
 13      2.0700000E-01          6.00816229361E-04      
S   13
  1      2.5490000E+05         -1.71283912535E-05      
  2      3.8190000E+04         -1.32588778334E-04      
  3      8.6900000E+03         -6.93097348117E-04      
  4      2.4620000E+03         -2.89048935927E-03      
  5      8.0480000E+02         -1.01895212805E-02      
  6      2.9130000E+02         -3.08757079424E-02      
  7      1.1360000E+02         -7.81371396963E-02      
  8      4.6750000E+01         -1.54420176670E-01      
  9      1.9820000E+01         -1.78729953027E-01      
 10      7.7080000E+00          8.33561141292E-02      
 11      3.3400000E+00          5.48630426904E-01      
 12      1.4020000E+00          4.76680741024E-01      
 13      2.0700000E-01         -1.03327420189E-02      
S   13
  1      2.5490000E+05          4.39547756252E-06      
  2      3.8190000E+04          3.40039454774E-05      
  3      8.6900000E+03          1.77949113091E-04      
  4      2.4620000E+03          7.41521665379E-04      
  5      8.0480000E+02          2.62182748896E-03      
  6      2.9130000E+02          7.95505593227E-03      
  7      1.1360000E+02          2.03516289227E-02      
  8      4.6750000E+01          4.08638203652E-02      
  9      1.9820000E+01          4.95162158981E-02      
 10      7.7080000E+00         -2.60207177962E-02      
 11      3.3400000E+00         -1.91812212600E-01      
 12      1.4020000E+00         -3.17412547605E-01      
 13      2.0700000E-01          6.81679549745E-01      
S   1
  1      4.3870000E-01          1.0000000        
S   1
  1      7.9440000E-02          1.0000000        
P   7
  1      4.8150000E+02          1.94934474894E-03      
  2      1.1390000E+02          1.54680565130E-02      
  3      3.6230000E+01          7.16366241069E-02      
  4      1.3340000E+01          2.13223961472E-01      
  5      5.2520000E+00          3.90089160126E-01      
  6      2.1200000E+00          3.93107724279E-01      
  7      2.5280000E-01          3.99331558613E-03      
P   7
  1      4.8150000E+02         -4.08558364300E-04      
  2      1.1390000E+02         -3.36860378701E-03      
  3      3.6230000E+01         -1.52262567483E-02      
  4      1.3340000E+01         -4.87707694530E-02      
  5      5.2520000E+00         -8.45897883524E-02      
  6      2.1200000E+00         -1.12360115003E-01      
  7      2.5280000E-01          5.35326834748E-01      
P   1
  1      8.5610000E-01          1.0000000        
P   1
  1      7.8890000E-02          1.0000000        
D   1
  1      4.8100000E-01          1.0000000        
D   1
  1      1.5900000E-01          1.0000000        
F   1
  1      3.3600000E-01          1.0000000


name: cc-pVTZ(pt/sf/sc)
description: VTZ2P Relativistic Valence Triple Zeta + Polarization
elt: P
data:
PHOSPHORUS
S   13
  1      3.1240000E+05          5.93871622734E-05      
  2      4.6800000E+04          4.59223322755E-04      
  3      1.0650000E+04          2.39520845783E-03      
  4      3.0180000E+03          9.92988319098E-03      
  5      9.8680000E+02          3.45133370797E-02      
  6      3.5740000E+02          1.00848052992E-01      
  7      1.3960000E+02          2.34902867637E-01      
  8      5.7630000E+01          3.81741494673E-01      
  9      2.4600000E+01          3.16245037740E-01      
 10      1.0120000E+01          7.00974221206E-02      
 11      4.2830000E+00         -1.79475111487E-03      
 12      1.8050000E+00          2.13470048855E-03      
 13      2.7820000E-01          4.26882452498E-04      
S   13
  1      3.1240000E+05         -1.62081030636E-05      
  2      4.6800000E+04         -1.25305833392E-04      
  3      1.0650000E+04         -6.55344681413E-04      
  4      3.0180000E+03         -2.72833220880E-03      
  5      9.8680000E+02         -9.64813854352E-03      
  6      3.5740000E+02         -2.92677833701E-02      
  7      1.3960000E+02         -7.50063600152E-02      
  8      5.7630000E+01         -1.50183593497E-01      
  9      2.4600000E+01         -1.87885935001E-01      
 10      1.0120000E+01          4.03176834983E-02      
 11      4.2830000E+00          5.30955117250E-01      
 12      1.8050000E+00          5.15107081068E-01      
 13      2.7820000E-01         -8.95831170627E-03      
S   13
  1      3.1240000E+05          4.46860235351E-06      
  2      4.6800000E+04          3.45184277066E-05      
  3      1.0650000E+04          1.80786392769E-04      
  4      3.0180000E+03          7.51731839945E-04      
  5      9.8680000E+02          2.66777351560E-03      
  6      3.5740000E+02          8.09806460797E-03      
  7      1.3960000E+02          2.10005702655E-02      
  8      5.7630000E+01          4.26634916595E-02      
  9      2.4600000E+01          5.60374051356E-02      
 10      1.0120000E+01         -1.41159324033E-02      
 11      4.2830000E+00         -1.98651431071E-01      
 12      1.8050000E+00         -3.53654305723E-01      
 13      2.7820000E-01          7.02974776112E-01      
S   1
  1      6.1580000E-01          1.0000000        
S   1
  1      1.0550000E-01          1.0000000        
P   7
  1      5.0490000E+02          2.37617622633E-03      
  2      1.1940000E+02          1.86913947687E-02      
  3      3.7960000E+01          8.52699970952E-02      
  4      1.3950000E+01          2.44780217845E-01      
  5      5.4570000E+00          4.22308458551E-01      
  6      2.1770000E+00          3.67577638943E-01      
  7      2.8770000E-01         -3.40187273566E-03      
P   7
  1      5.0490000E+02         -5.61184923734E-04      
  2      1.1940000E+02         -4.47246507830E-03      
  3      3.7960000E+01         -2.05850340119E-02      
  4      1.3950000E+01         -6.14809690456E-02      
  5      5.4570000E+00         -1.08088397139E-01      
  6      2.1770000E+00         -1.04741772862E-01      
  7      2.8770000E-01          5.46207812287E-01      
P   1
  1      8.0100000E-01          1.0000000        
P   1
  1      9.7140000E-02          1.0000000        
D   1
  1      6.5200000E-01          1.0000000        
D   1
  1      2.1600000E-01          1.0000000        
F   1
  1      4.5200000E-01          1.0000000


