# all_value

name: cc-pV5Z(fi/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   22
  1      1.8282209E+08          7.32129433614E-08      
  2      2.7356156E+07          1.54461916193E-06      
  3      6.2211704E+06          8.81729306383E-06      
  4      1.7602779E+06          3.72980512010E-05      
  5      5.7319382E+05          1.34729590984E-04      
  6      2.0625845E+05          4.36629325082E-04      
  7      8.0026669E+04          1.30361032557E-03      
  8      3.2939084E+04          3.64071079803E-03      
  9      1.4222633E+04          9.57789815549E-03      
 10      6.3930707E+03          2.37129022133E-02      
 11      2.9764538E+03          5.45891178528E-02      
 12      1.4305254E+03          1.13797851693E-01      
 13      7.0792621E+02          2.04419125720E-01      
 14      3.5984847E+02          2.89736576569E-01      
 15      1.8714965E+02          2.77001746851E-01      
 16      9.8634523E+01          1.38849193919E-01      
 17      5.0547869E+01          2.24771606739E-02      
 18      2.7167004E+01         -8.51940828539E-05      
 19      1.4615098E+01          5.08802406285E-04      
 20      7.6513520E+00         -2.67597231249E-04      
 21      3.9972630E+00          8.86277953163E-05      
 22      2.0858530E+00         -7.36720840604E-05      
S   22
  1      1.8282209E+08         -2.37335870332E-08      
  2      2.7356156E+07         -5.00574442195E-07      
  3      6.2211704E+06         -2.85843035388E-06      
  4      1.7602779E+06         -1.20891436602E-05      
  5      5.7319382E+05         -4.37003669201E-05      
  6      2.0625845E+05         -1.41640408594E-04      
  7      8.0026669E+04         -4.23726917900E-04      
  8      3.2939084E+04         -1.18598709860E-03      
  9      1.4222633E+04         -3.14206520175E-03      
 10      6.3930707E+03         -7.87146353979E-03      
 11      2.9764538E+03         -1.86159222643E-02      
 12      1.4305254E+03         -4.07571915256E-02      
 13      7.0792621E+02         -8.07209987010E-02      
 14      3.5984847E+02         -1.35824836000E-01      
 15      1.8714965E+02         -1.72036082499E-01      
 16      9.8634523E+01         -8.81519643167E-02      
 17      5.0547869E+01          2.14322623384E-01      
 18      2.7167004E+01          5.09853378157E-01      
 19      1.4615098E+01          3.72440068907E-01      
 20      7.6513520E+00          8.08748478876E-02      
 21      3.9972630E+00          3.54240569227E-03      
 22      2.0858530E+00          1.38734473216E-03      
S   22
  1      1.8282209E+08          9.55486651401E-09      
  2      2.7356156E+07          2.01497481822E-07      
  3      6.2211704E+06          1.15075680466E-06      
  4      1.7602779E+06          4.86625656727E-06      
  5      5.7319382E+05          1.75947428443E-05      
  6      2.0625845E+05          5.70193023697E-05      
  7      8.0026669E+04          1.70654816670E-04      
  8      3.2939084E+04          4.77684306114E-04      
  9      1.4222633E+04          1.26705079562E-03      
 10      6.3930707E+03          3.17822517968E-03      
 11      2.9764538E+03          7.54613515831E-03      
 12      1.4305254E+03          1.66237045514E-02      
 13      7.0792621E+02          3.33821496368E-02      
 14      3.5984847E+02          5.75246171670E-02      
 15      1.8714965E+02          7.61593901606E-02      
 16      9.8634523E+01          4.09211122930E-02      
 17      5.0547869E+01         -1.21010204978E-01      
 18      2.7167004E+01         -3.82792576418E-01      
 19      1.4615098E+01         -3.79306980805E-01      
 20      7.6513520E+00          1.36728020620E-01      
 21      3.9972630E+00          6.52070873591E-01      
 22      2.0858530E+00          4.56997198462E-01      
S   22
  1      1.8282209E+08         -3.05124978766E-09      
  2      2.7356156E+07         -6.43258063523E-08      
  3      6.2211704E+06         -3.67463137031E-07      
  4      1.7602779E+06         -1.55339539834E-06      
  5      5.7319382E+05         -5.61893815095E-06      
  6      2.0625845E+05         -1.82002148610E-05      
  7      8.0026669E+04         -5.45068884830E-05      
  8      3.2939084E+04         -1.52471290334E-04      
  9      1.4222633E+04         -4.04816832443E-04      
 10      6.3930707E+03         -1.01472176011E-03      
 11      2.9764538E+03         -2.41327677534E-03      
 12      1.4305254E+03         -5.31486760455E-03      
 13      7.0792621E+02         -1.07125641494E-02      
 14      3.5984847E+02         -1.84909663878E-02      
 15      1.8714965E+02         -2.47351517514E-02      
 16      9.8634523E+01         -1.32700533872E-02      
 17      5.0547869E+01          4.04786283387E-02      
 18      2.7167004E+01          1.36113022380E-01      
 19      1.4615098E+01          1.39075394384E-01      
 20      7.6513520E+00         -5.85475183346E-02      
 21      3.9972630E+00         -3.34435021851E-01      
 22      2.0858530E+00         -4.20220147508E-01      
S   1
  1      1.0147970E+00          1.0000000        
S   1
  1      5.1978800E-01          1.0000000        
S   1
  1      2.4510300E-01          1.0000000        
S   1
  1      1.1189600E-01          1.0000000        
P   13
  1      4.2993056E+04          3.96225850020E-05      
  2      1.0173723E+04          3.15348993133E-04      
  3      3.3031057E+03          1.72738660328E-03      
  4      1.2635400E+03          7.45506262377E-03      
  5      5.3636546E+02          2.64333762746E-02      
  6      2.4487617E+02          7.73211961311E-02      
  7      1.1799117E+02          1.79157406838E-01      
  8      5.9021248E+01          3.07519226502E-01      
  9      3.0356067E+01          3.42360830942E-01      
 10      1.5819977E+01          1.94570666674E-01      
 11      8.1045800E+00          4.08240321727E-02      
 12      4.0979640E+00          1.91427647388E-03      
 13      2.0560610E+00          1.95415348229E-04      
P   13
  1      4.2993056E+04         -1.62148977358E-05      
  2      1.0173723E+04         -1.29123159508E-04      
  3      3.3031057E+03         -7.09522466047E-04      
  4      1.2635400E+03         -3.07811900179E-03      
  5      5.3636546E+02         -1.10545682056E-02      
  6      2.4487617E+02         -3.31217406714E-02      
  7      1.1799117E+02         -7.98601036659E-02      
  8      5.9021248E+01         -1.44254026371E-01      
  9      3.0356067E+01         -1.65643202296E-01      
 10      1.5819977E+01         -9.48636594859E-03      
 11      8.1045800E+00          3.06955319514E-01      
 12      4.0979640E+00          4.82743037342E-01      
 13      2.0560610E+00          2.89365865188E-01      
P   13
  1      4.2993056E+04          4.40609224147E-06      
  2      1.0173723E+04          3.49951178322E-05      
  3      3.3031057E+03          1.92924554177E-04      
  4      1.2635400E+03          8.35128575553E-04      
  5      5.3636546E+02          3.01331134768E-03      
  6      2.4487617E+02          9.02943915801E-03      
  7      1.1799117E+02          2.19689272775E-02      
  8      5.9021248E+01          3.97964520597E-02      
  9      3.0356067E+01          4.63379286236E-02      
 10      1.5819977E+01         -3.09932782647E-03      
 11      8.1045800E+00         -1.04157795826E-01      
 12      4.0979640E+00         -1.81937718789E-01      
 13      2.0560610E+00         -1.11506387882E-01      
P   1
  1      9.5214500E-01          1.0000000        
P   1
  1      4.4477400E-01          1.0000000        
P   1
  1      1.9749600E-01          1.0000000        
P   1
  1      8.3823000E-02          1.0000000        
D   9
  1      2.0674360E+03          5.27681179382E-05      
  2      6.2569371E+02          5.10366222276E-04      
  3      2.4394679E+02          3.07670113567E-03      
  4      1.0842373E+02          1.34041018840E-02      
  5      5.2005216E+01          4.36415370296E-02      
  6      2.6115405E+01          1.10803439306E-01      
  7      1.3546748E+01          2.11675999335E-01      
  8      7.1058100E+00          2.96399940389E-01      
  9      3.7215540E+00          3.07475131821E-01      
D   1
  1      1.9291200E+00          1.0000000        
D   1
  1      9.5582600E-01          1.0000000        
D   1
  1      4.0519700E-01          1.0000000        
D   1
  1      1.7410000E-01          1.0000000        
F   1
  1      1.0940000E+00          1.0000000        
F   1
  1      5.8700000E-01          1.0000000        
F   1
  1      3.1500000E-01          1.0000000        
G   1
  1      1.1040000E+00          1.0000000        
G   1
  1      5.0100000E-01          1.0000000        
H   1
  1      9.3030000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: H
data:
HYDROGEN
S   4
  1      4.0200000E+02          2.79447563983E-04      
  2      6.0240000E+01          2.16562288608E-03      
  3      1.3730000E+01          1.12022216270E-02      
  4      3.9050000E+00          4.48798016559E-02      
S   1
  1      1.2830000E+00          1.0000000        
S   1
  1      4.6550000E-01          1.0000000        
S   1
  1      1.8110000E-01          1.0000000        
S   1
  1      7.2790000E-02          1.0000000        
P   1
  1      4.5160000E+00          1.0000000        
P   1
  1      1.7120000E+00          1.0000000        
P   1
  1      6.4900000E-01          1.0000000        
P   1
  1      2.4600000E-01          1.0000000        
D   1
  1      2.9500000E+00          1.0000000        
D   1
  1      1.2060000E+00          1.0000000        
D   1
  1      4.9300000E-01          1.0000000        
F   1
  1      8.7500000E-01          1.0000000        
F   1
  1      2.5060000E+00          1.0000000        
G   1
  1      2.3580000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      1.1450000E+03          3.58669790560E-04      
  2      1.7170000E+02          2.77177387557E-03      
  3      3.9070000E+01          1.42537433249E-02      
  4      1.1040000E+01          5.55731418684E-02      
S   1
  1      3.5660000E+00          1.0000000        
S   1
  1      1.2400000E+00          1.0000000        
S   1
  1      4.4730000E-01          1.0000000        
S   1
  1      1.6400000E-01          1.0000000        
P   1
  1      1.0153000E+01          1.0000000        
P   1
  1      3.6270000E+00          1.0000000        
P   1
  1      1.2960000E+00          1.0000000        
P   1
  1      4.6300000E-01          1.0000000        
D   1
  1      7.6660000E+00          1.0000000        
D   1
  1      2.6470000E+00          1.0000000        
D   1
  1      9.1400000E-01          1.0000000        
F   1
  1      5.4110000E+00          1.0000000        
F   1
  1      1.7070000E+00          1.0000000        
G   1
  1      3.4300000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: B
data:
BORON
S   10
  1      6.8260000E+04          2.38605894755E-05      
  2      1.0230000E+04          1.85308551524E-04      
  3      2.3280000E+03          9.72196334756E-04      
  4      6.6040000E+02          4.06354325203E-03      
  5      2.1620000E+02          1.44191551149E-02      
  6      7.8600000E+01          4.39440745531E-02      
  7      3.0980000E+01          1.13119182903E-01      
  8      1.2960000E+01          2.33863188257E-01      
  9      5.6590000E+00          3.53891327880E-01      
 10      2.5560000E+00          3.01375766831E-01      
S   10
  1      6.8260000E+04         -4.81453356238E-06      
  2      1.0230000E+04         -3.75063548353E-05      
  3      2.3280000E+03         -1.96074151637E-04      
  4      6.6040000E+02         -8.25983488034E-04      
  5      2.1620000E+02         -2.92800801362E-03      
  6      7.8600000E+01         -9.15054631539E-03      
  7      3.0980000E+01         -2.41274308920E-02      
  8      1.2960000E+01         -5.47856156270E-02      
  9      5.6590000E+00         -9.69488131197E-02      
 10      2.5560000E+00         -1.37443300958E-01      
S   1
  1      1.1750000E+00          1.0000000        
S   1
  1      4.2490000E-01          1.0000000        
S   1
  1      1.7120000E-01          1.0000000        
S   1
  1      6.9130000E-02          1.0000000        
P   4
  1      6.6440000E+01          8.39512523073E-04      
  2      1.5710000E+01          6.41101917974E-03      
  3      4.9360000E+00          2.80789325188E-02      
  4      1.7700000E+00          9.21361253910E-02      
P   1
  1      7.0080000E-01          1.0000000        
P   1
  1      2.9010000E-01          1.0000000        
P   1
  1      1.2110000E-01          1.0000000        
P   1
  1      4.9730000E-02          1.0000000        
D   1
  1      2.0100000E+00          1.0000000        
D   1
  1      7.9600000E-01          1.0000000        
D   1
  1      3.1600000E-01          1.0000000        
D   1
  1      1.2500000E-01          1.0000000        
F   1
  1      1.2150000E+00          1.0000000        
F   1
  1      5.2500000E-01          1.0000000        
F   1
  1      2.2700000E-01          1.0000000        
G   1
  1      1.1240000E+00          1.0000000        
G   1
  1      4.6100000E-01          1.0000000        
H   1
  1      8.3400000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: C
data:
CARBON
S   10
  1      9.6770000E+04          2.46273560906E-05      
  2      1.4500000E+04          1.91225153463E-04      
  3      3.3000000E+03          1.00300673817E-03      
  4      9.3580000E+02          4.19501271251E-03      
  5      3.0620000E+02          1.48905426894E-02      
  6      1.1130000E+02          4.53677215224E-02      
  7      4.3900000E+01          1.16601039987E-01      
  8      1.8400000E+01          2.40314131984E-01      
  9      8.0540000E+00          3.58716949194E-01      
 10      3.6370000E+00          2.93716700797E-01      
S   10
  1      9.6770000E+04         -5.25905234142E-06      
  2      1.4500000E+04         -4.09407173761E-05      
  3      3.3000000E+03         -2.14149375975E-04      
  4      9.3580000E+02         -9.01964915024E-04      
  5      3.0620000E+02         -3.20403502694E-03      
  6      1.1130000E+02         -1.00068122636E-02      
  7      4.3900000E+01         -2.64812336631E-02      
  8      1.8400000E+01         -6.02055587605E-02      
  9      8.0540000E+00         -1.07152407937E-01      
 10      3.6370000E+00         -1.44532729630E-01      
S   1
  1      1.6560000E+00          1.0000000        
S   1
  1      6.3330000E-01          1.0000000        
S   1
  1      2.5450000E-01          1.0000000        
S   1
  1      1.0190000E-01          1.0000000        
P   4
  1      1.0180000E+02          8.85978796925E-04      
  2      2.4040000E+01          6.92776047417E-03      
  3      7.5710000E+00          3.14526600496E-02      
  4      2.7320000E+00          1.03498524900E-01      
P   1
  1      1.0850000E+00          1.0000000        
P   1
  1      4.4960000E-01          1.0000000        
P   1
  1      1.8760000E-01          1.0000000        
P   1
  1      7.6060000E-02          1.0000000        
D   1
  1      3.1340000E+00          1.0000000        
D   1
  1      1.2330000E+00          1.0000000        
D   1
  1      4.8500000E-01          1.0000000        
D   1
  1      1.9100000E-01          1.0000000        
F   1
  1      2.0060000E+00          1.0000000        
F   1
  1      8.3800000E-01          1.0000000        
F   1
  1      3.5000000E-01          1.0000000        
G   1
  1      1.7530000E+00          1.0000000        
G   1
  1      6.7800000E-01          1.0000000        
H   1
  1      1.2590000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: N
data:
NITROGEN
S   10
  1      1.2920000E+05          2.54675100453E-05      
  2      1.9350000E+04          1.97701583609E-04      
  3      4.4040000E+03          1.03714419072E-03      
  4      1.2480000E+03          4.34121056467E-03      
  5      4.0800000E+02          1.54250398747E-02      
  6      1.4820000E+02          4.69623289944E-02      
  7      5.8500000E+01          1.20255355715E-01      
  8      2.4590000E+01          2.45790472103E-01      
  9      1.0810000E+01          3.61278938610E-01      
 10      4.8820000E+00          2.86982426171E-01      
S   10
  1      1.2920000E+05         -5.64123491663E-06      
  2      1.9350000E+04         -4.38838315416E-05      
  3      4.4040000E+03         -2.29760608518E-04      
  4      1.2480000E+03         -9.67671910909E-04      
  5      4.0800000E+02         -3.44672501811E-03      
  6      1.4820000E+02         -1.07517079734E-02      
  7      5.8500000E+01         -2.84822219042E-02      
  8      2.4590000E+01         -6.44223097080E-02      
  9      1.0810000E+01         -1.14620860920E-01      
 10      4.8820000E+00         -1.47761932191E-01      
S   1
  1      2.1950000E+00          1.0000000        
S   1
  1      8.7150000E-01          1.0000000        
S   1
  1      3.5040000E-01          1.0000000        
S   1
  1      1.3970000E-01          1.0000000        
P   4
  1      1.4700000E+02          8.84926062974E-04      
  2      3.4760000E+01          7.01792575786E-03      
  3      1.1000000E+01          3.25313975909E-02      
  4      3.9950000E+00          1.07600210147E-01      
P   1
  1      1.5870000E+00          1.0000000        
P   1
  1      6.5330000E-01          1.0000000        
P   1
  1      2.6860000E-01          1.0000000        
P   1
  1      1.0670000E-01          1.0000000        
D   1
  1      4.6470000E+00          1.0000000        
D   1
  1      1.8130000E+00          1.0000000        
D   1
  1      7.0700000E-01          1.0000000        
D   1
  1      2.7600000E-01          1.0000000        
F   1
  1      2.9420000E+00          1.0000000        
F   1
  1      1.2040000E+00          1.0000000        
F   1
  1      4.9300000E-01          1.0000000        
G   1
  1      2.5110000E+00          1.0000000        
G   1
  1      9.4200000E-01          1.0000000        
H   1
  1      1.7680000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: O
data:
OXYGEN
S   10
  1      1.6420000E+05          2.65442738989E-05      
  2      2.4590000E+04          2.06122972761E-04      
  3      5.5920000E+03          1.08242310513E-03      
  4      1.5820000E+03          4.54375737968E-03      
  5      5.1610000E+02          1.61673404830E-02      
  6      1.8720000E+02          4.92097093157E-02      
  7      7.3930000E+01          1.25032444399E-01      
  8      3.1220000E+01          2.51779518149E-01      
  9      1.3810000E+01          3.62200418942E-01      
 10      6.2560000E+00          2.78595717013E-01      
S   10
  1      1.6420000E+05         -6.03377135491E-06      
  2      2.4590000E+04         -4.69328875433E-05      
  3      5.5920000E+03         -2.46134603496E-04      
  4      1.5820000E+03         -1.03893337623E-03      
  5      5.1610000E+02         -3.71127234285E-03      
  6      1.8720000E+02         -1.15724722826E-02      
  7      7.3930000E+01         -3.05549682839E-02      
  8      3.1220000E+01         -6.83336545342E-02      
  9      1.3810000E+01         -1.20570571235E-01      
 10      6.2560000E+00         -1.48202812445E-01      
S   1
  1      2.7760000E+00          1.0000000        
S   1
  1      1.1380000E+00          1.0000000        
S   1
  1      4.6000000E-01          1.0000000        
S   1
  1      1.8290000E-01          1.0000000        
P   4
  1      1.9550000E+02          9.20570816262E-04      
  2      4.6160000E+01          7.38866794699E-03      
  3      1.4580000E+01          3.49307883133E-02      
  4      5.2960000E+00          1.15327782388E-01      
P   1
  1      2.0940000E+00          1.0000000        
P   1
  1      8.4710000E-01          1.0000000        
P   1
  1      3.3680000E-01          1.0000000        
P   1
  1      1.2850000E-01          1.0000000        
D   1
  1      5.8790000E+00          1.0000000        
D   1
  1      2.3070000E+00          1.0000000        
D   1
  1      9.0500000E-01          1.0000000        
D   1
  1      3.5500000E-01          1.0000000        
F   1
  1      4.0160000E+00          1.0000000        
F   1
  1      1.5540000E+00          1.0000000        
F   1
  1      6.0100000E-01          1.0000000        
G   1
  1      3.3500000E+00          1.0000000        
G   1
  1      1.1890000E+00          1.0000000        
H   1
  1      2.3190000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: F
data:
FLUORINE
S   10
  1      2.1140000E+05          2.61476202263E-05      
  2      3.1660000E+04          2.03018733020E-04      
  3      7.2020000E+03          1.06439473220E-03      
  4      2.0400000E+03          4.45975468468E-03      
  5      6.6640000E+02          1.58400302530E-02      
  6      2.4200000E+02          4.82670901925E-02      
  7      9.5530000E+01          1.23453497167E-01      
  8      4.0230000E+01          2.51636340125E-01      
  9      1.7720000E+01          3.64223922386E-01      
 10      8.0050000E+00          2.79170677510E-01      
S   10
  1      2.1140000E+05         -6.05902360209E-06      
  2      3.1660000E+04         -4.71214562327E-05      
  3      7.2020000E+03         -2.46742386974E-04      
  4      2.0400000E+03         -1.03947438265E-03      
  5      6.6640000E+02         -3.70702409013E-03      
  6      2.4200000E+02         -1.15705087014E-02      
  7      9.5530000E+01         -3.07708907394E-02      
  8      4.0230000E+01         -6.97117663694E-02      
  9      1.7720000E+01         -1.24036288251E-01      
 10      8.0050000E+00         -1.49837662481E-01      
S   1
  1      3.5380000E+00          1.0000000        
S   1
  1      1.4580000E+00          1.0000000        
S   1
  1      5.8870000E-01          1.0000000        
S   1
  1      2.3240000E-01          1.0000000        
P   4
  1      2.4190000E+02          1.00774061059E-03      
  2      5.7170000E+01          8.07639190014E-03      
  3      1.8130000E+01          3.80905720369E-02      
  4      6.6240000E+00          1.23814044889E-01      
P   1
  1      2.6220000E+00          1.0000000        
P   1
  1      1.0570000E+00          1.0000000        
P   1
  1      4.1760000E-01          1.0000000        
P   1
  1      1.5740000E-01          1.0000000        
D   1
  1      7.7600000E+00          1.0000000        
D   1
  1      3.0320000E+00          1.0000000        
D   1
  1      1.1850000E+00          1.0000000        
D   1
  1      4.6300000E-01          1.0000000        
F   1
  1      5.3980000E+00          1.0000000        
F   1
  1      2.0780000E+00          1.0000000        
F   1
  1      8.0000000E-01          1.0000000        
G   1
  1      4.3380000E+00          1.0000000        
G   1
  1      1.5130000E+00          1.0000000        
H   1
  1      2.9950000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ne
data:
NEON
S   10
  1      2.6270000E+05          2.60909835220E-05      
  2      3.9350000E+04          2.02332267723E-04      
  3      8.9550000E+03          1.06036573415E-03      
  4      2.5380000E+03          4.43349683773E-03      
  5      8.2990000E+02          1.57401200852E-02      
  6      3.0150000E+02          4.79499509266E-02      
  7      1.1900000E+02          1.23219148322E-01      
  8      5.0000000E+01          2.52630719580E-01      
  9      2.1980000E+01          3.65933424021E-01      
 10      9.8910000E+00          2.78874577536E-01      
S   10
  1      2.6270000E+05         -6.13793419974E-06      
  2      3.9350000E+04         -4.76639358483E-05      
  3      8.9550000E+03         -2.49585761534E-04      
  4      2.5380000E+03         -1.04870052558E-03      
  5      8.2990000E+02         -3.74116741699E-03      
  6      3.0150000E+02         -1.16655473609E-02      
  7      1.1900000E+02         -3.12241755636E-02      
  8      5.0000000E+01         -7.11519644005E-02      
  9      2.1980000E+01         -1.27323803096E-01      
 10      9.8910000E+00         -1.50721066060E-01      
S   1
  1      4.3270000E+00          1.0000000        
S   1
  1      1.8040000E+00          1.0000000        
S   1
  1      7.2880000E-01          1.0000000        
S   1
  1      2.8670000E-01          1.0000000        
P   4
  1      2.9910000E+02          1.04615907391E-03      
  2      7.0730000E+01          8.40553963959E-03      
  3      2.2480000E+01          3.97543561909E-02      
  4      8.2460000E+00          1.28109603308E-01      
P   1
  1      3.2690000E+00          1.0000000        
P   1
  1      1.3150000E+00          1.0000000        
P   1
  1      5.1580000E-01          1.0000000        
P   1
  1      1.9180000E-01          1.0000000        
D   1
  1      9.8370000E+00          1.0000000        
D   1
  1      3.8440000E+00          1.0000000        
D   1
  1      1.5020000E+00          1.0000000        
D   1
  1      5.8700000E-01          1.0000000        
F   1
  1      7.0900000E+00          1.0000000        
F   1
  1      2.7380000E+00          1.0000000        
F   1
  1      1.0570000E+00          1.0000000        
G   1
  1      5.4600000E+00          1.0000000        
G   1
  1      1.8800000E+00          1.0000000        
H   1
  1      3.7760000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   16
  1      3.2690000E+06          2.19973581947E-06      
  2      4.8940000E+05          1.70339278626E-05      
  3      1.1140000E+05          8.93589873554E-05      
  4      3.1560000E+04          3.75647763257E-04      
  5      1.0320000E+04          1.35946702848E-03      
  6      3.7310000E+03          4.41135863506E-03      
  7      1.4560000E+03          1.30246946843E-02      
  8      6.0410000E+02          3.50778348670E-02      
  9      2.6350000E+02          8.47533411113E-02      
 10      1.1980000E+02          1.76283306654E-01      
 11      5.6320000E+01          2.91972231810E-01      
 12      2.7190000E+01          3.27250543663E-01      
 13      1.3260000E+01          1.85917999726E-01      
 14      6.0520000E+00          3.08011658254E-02      
 15      2.9810000E+00         -5.01194749511E-04      
 16      1.4760000E+00          1.47528252896E-03      
S   16
  1      3.2690000E+06         -5.73682140924E-07      
  2      4.8940000E+05         -4.44483515927E-06      
  3      1.1140000E+05         -2.33030239484E-05      
  4      3.1560000E+04         -9.80981576416E-05      
  5      1.0320000E+04         -3.54975135124E-04      
  6      3.7310000E+03         -1.15700812244E-03      
  7      1.4560000E+03         -3.43399139994E-03      
  8      6.0410000E+02         -9.41933479945E-03      
  9      2.6350000E+02         -2.34965189052E-02      
 10      1.1980000E+02         -5.26413500959E-02      
 11      5.6320000E+01         -1.00179133784E-01      
 12      2.7190000E+01         -1.50331489350E-01      
 13      1.3260000E+01         -1.17548434723E-01      
 14      6.0520000E+00          1.10558878007E-01      
 15      2.9810000E+00          4.12189568111E-01      
 16      1.4760000E+00          4.55719993232E-01      
S   16
  1      3.2690000E+06          1.32518719511E-07      
  2      4.8940000E+05          1.02572537516E-06      
  3      1.1140000E+05          5.38540751652E-06      
  4      3.1560000E+04          2.26282363836E-05      
  5      1.0320000E+04          8.20867777994E-05      
  6      3.7310000E+03          2.66823317270E-04      
  7      1.4560000E+03          7.95170532617E-04      
  8      6.0410000E+02          2.17454139633E-03      
  9      2.6350000E+02          5.46642250179E-03      
 10      1.1980000E+02          1.22362513330E-02      
 11      5.6320000E+01          2.37460707387E-02      
 12      2.7190000E+01          3.60278215841E-02      
 13      1.3260000E+01          2.99538062840E-02      
 14      6.0520000E+00         -3.17003761744E-02      
 15      2.9810000E+00         -1.19476418067E-01      
 16      1.4760000E+00         -2.11588036939E-01      
S   1
  1      7.3340000E-01          1.0000000        
S   1
  1      2.4470000E-01          1.0000000        
S   1
  1      1.0880000E-01          1.0000000        
S   1
  1      4.6720000E-02          1.0000000        
P   8
  1      1.4610000E+03          2.13283757919E-04      
  2      3.4620000E+02          1.83208271390E-03      
  3      1.1220000E+02          9.79942829626E-03      
  4      4.2510000E+01          3.79607776715E-02      
  5      1.7720000E+01          1.11064541803E-01      
  6      7.8520000E+00          2.34302855914E-01      
  7      3.5710000E+00          3.44993715145E-01      
  8      1.6370000E+00          3.31027870505E-01      
P   8
  1      1.4610000E+03         -3.80066353519E-05      
  2      3.4620000E+02         -3.32282780888E-04      
  3      1.1220000E+02         -1.75308125981E-03      
  4      4.2510000E+01         -6.96726676754E-03      
  5      1.7720000E+01         -2.02939517105E-02      
  6      7.8520000E+00         -4.48201410147E-02      
  7      3.5710000E+00         -6.42088834326E-02      
  8      1.6370000E+00         -7.50992174496E-02      
P   1
  1      7.3820000E-01          1.0000000        
P   1
  1      2.5770000E-01          1.0000000        
P   1
  1      9.7730000E-02          1.0000000        
P   1
  1      3.6900000E-02          1.0000000        
D   1
  1      1.3170000E+00          1.0000000        
D   1
  1      5.2600000E-01          1.0000000        
D   1
  1      2.1000000E-01          1.0000000        
D   1
  1      8.4000000E-02          1.0000000        
F   1
  1      5.1300000E-01          1.0000000        
F   1
  1      2.5800000E-01          1.0000000        
F   1
  1      1.3000000E-01          1.0000000        
G   1
  1      5.4300000E-01          1.0000000        
G   1
  1      2.5200000E-01          1.0000000        
H   1
  1      4.4600000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Si
data:
SILICON
S   16
  1      3.9480000E+06          2.10391437158E-06      
  2      5.9110000E+05          1.62925708712E-05      
  3      1.3450000E+05          8.54083964365E-05      
  4      3.8120000E+04          3.58770244383E-04      
  5      1.2460000E+04          1.29940304924E-03      
  6      4.5040000E+03          4.21334747395E-03      
  7      1.7580000E+03          1.24479433173E-02      
  8      7.2910000E+02          3.36016080849E-02      
  9      3.1800000E+02          8.14439972744E-02      
 10      1.4460000E+02          1.70740063728E-01      
 11      6.7970000E+01          2.86784716375E-01      
 12      3.2820000E+01          3.29251623671E-01      
 13      1.6030000E+01          1.95393687926E-01      
 14      7.3960000E+00          3.51367925112E-02      
 15      3.6610000E+00         -5.27061842248E-04      
 16      1.8230000E+00          1.59801082354E-03      
S   16
  1      3.9480000E+06         -5.62188783777E-07      
  2      5.9110000E+05         -4.35555857219E-06      
  3      1.3450000E+05         -2.28215849200E-05      
  4      3.8120000E+04         -9.59815673374E-05      
  5      1.2460000E+04         -3.47657280394E-04      
  6      4.5040000E+03         -1.13193215832E-03      
  7      1.7580000E+03         -3.36219912271E-03      
  8      7.2910000E+02         -9.23625897917E-03      
  9      3.1800000E+02         -2.31053517302E-02      
 10      1.4460000E+02         -5.20581991825E-02      
 11      6.7970000E+01         -1.00197227836E-01      
 12      3.2820000E+01         -1.52508832337E-01      
 13      1.6030000E+01         -1.25698936549E-01      
 14      7.3960000E+00          9.76563993361E-02      
 15      3.6610000E+00          4.15428631437E-01      
 16      1.8230000E+00          4.66090820945E-01      
S   16
  1      3.9480000E+06          1.44340264592E-07      
  2      5.9110000E+05          1.11726837579E-06      
  3      1.3450000E+05          5.86185198693E-06      
  4      3.8120000E+04          2.46113116349E-05      
  5      1.2460000E+04          8.93496294517E-05      
  6      4.5040000E+03          2.90196994709E-04      
  7      1.7580000E+03          8.65259039703E-04      
  8      7.2910000E+02          2.37082495325E-03      
  9      3.1800000E+02          5.97493964548E-03      
 10      1.4460000E+02          1.34624610332E-02      
 11      6.7970000E+01          2.64180117249E-02      
 12      3.2820000E+01          4.07576335565E-02      
 13      1.6030000E+01          3.56965872605E-02      
 14      7.3960000E+00         -3.14318478221E-02      
 15      3.6610000E+00         -1.36978007425E-01      
 16      1.8230000E+00         -2.50849159412E-01      
S   1
  1      9.1470000E-01          1.0000000        
S   1
  1      3.3930000E-01          1.0000000        
S   1
  1      1.5000000E-01          1.0000000        
S   1
  1      6.4380000E-02          1.0000000        
P   8
  1      1.7800000E+03          2.06584275230E-04      
  2      4.2180000E+02          1.77502528198E-03      
  3      1.3670000E+02          9.55903576975E-03      
  4      5.1810000E+01          3.73964784271E-02      
  5      2.1600000E+01          1.10979450580E-01      
  6      9.5630000E+00          2.37970018915E-01      
  7      4.3500000E+00          3.53386300979E-01      
  8      2.0060000E+00          3.28299135926E-01      
P   8
  1      1.7800000E+03         -4.35605590378E-05      
  2      4.2180000E+02         -3.80126430022E-04      
  3      1.3670000E+02         -2.02490180841E-03      
  4      5.1810000E+01         -8.11316548984E-03      
  5      2.1600000E+01         -2.41020936824E-02      
  6      9.5630000E+00         -5.40403890624E-02      
  7      4.3500000E+00         -7.92069175416E-02      
  8      2.0060000E+00         -8.84593796695E-02      
P   1
  1      9.2050000E-01          1.0000000        
P   1
  1      3.5000000E-01          1.0000000        
P   1
  1      1.3810000E-01          1.0000000        
P   1
  1      5.3380000E-02          1.0000000        
D   1
  1      2.0820000E+00          1.0000000        
D   1
  1      8.1700000E-01          1.0000000        
D   1
  1      3.2100000E-01          1.0000000        
D   1
  1      1.2600000E-01          1.0000000        
F   1
  1      6.8800000E-01          1.0000000        
F   1
  1      3.4100000E-01          1.0000000        
F   1
  1      1.6900000E-01          1.0000000        
G   1
  1      7.0500000E-01          1.0000000        
G   1
  1      3.2000000E-01          1.0000000        
H   1
  1      5.8300000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: P
data:
PHOSPHOROUS
S   16
  1      4.6660000E+06          2.04206457182E-06      
  2      6.9860000E+05          1.58014345976E-05      
  3      1.5900000E+05          8.27675160124E-05      
  4      4.5040000E+04          3.48011649126E-04      
  5      1.4720000E+04          1.25837069898E-03      
  6      5.3230000E+03          4.08218299873E-03      
  7      2.0760000E+03          1.20751444789E-02      
  8      8.6110000E+02          3.25795383762E-02      
  9      3.7570000E+02          7.91881210421E-02      
 10      1.7080000E+02          1.66984949869E-01      
 11      8.0290000E+01          2.82966122905E-01      
 12      3.8770000E+01          3.30719789293E-01      
 13      1.8930000E+01          2.01934104638E-01      
 14      8.7960000E+00          3.79259732490E-02      
 15      4.3580000E+00         -3.77745026495E-04      
 16      2.1740000E+00          1.56789734727E-03      
S   16
  1      4.6660000E+06         -5.57049292588E-07      
  2      6.9860000E+05         -4.31226125236E-06      
  3      1.5900000E+05         -2.25778760620E-05      
  4      4.5040000E+04         -9.50410085108E-05      
  5      1.4720000E+04         -3.43712533902E-04      
  6      5.3230000E+03         -1.11943572239E-03      
  7      2.0760000E+03         -3.32924729231E-03      
  8      8.6110000E+02         -9.13762075030E-03      
  9      3.7570000E+02         -2.29153947161E-02      
 10      1.7080000E+02         -5.18710712780E-02      
 11      8.0290000E+01         -1.00539288151E-01      
 12      3.8770000E+01         -1.54822560341E-01      
 13      1.8930000E+01         -1.31738710582E-01      
 14      8.7960000E+00          9.13605010543E-02      
 15      4.3580000E+00          4.24310712201E-01      
 16      2.1740000E+00          4.72587452879E-01      
S   16
  1      4.6660000E+06          1.53621660545E-07      
  2      6.9860000E+05          1.18839528382E-06      
  3      1.5900000E+05          6.22853914927E-06      
  4      4.5040000E+04          2.61844344266E-05      
  5      1.4720000E+04          9.48657928916E-05      
  6      5.3230000E+03          3.08398254727E-04      
  7      2.0760000E+03          9.20035263243E-04      
  8      8.6110000E+02          2.52101124916E-03      
  9      3.7570000E+02          6.36342069325E-03      
 10      1.7080000E+02          1.44275069728E-02      
 11      8.0290000E+01          2.84774005704E-02      
 12      3.8770000E+01          4.46141619279E-02      
 13      1.8930000E+01          4.01967919404E-02      
 14      8.7960000E+00         -3.15050010192E-02      
 15      4.3580000E+00         -1.54666793369E-01      
 16      2.1740000E+00         -2.83439760540E-01      
S   1
  1      1.0950000E+00          1.0000000        
S   1
  1      4.4000000E-01          1.0000000        
S   1
  1      1.9450000E-01          1.0000000        
S   1
  1      8.3760000E-02          1.0000000        
P   8
  1      2.0100000E+03          2.22520649946E-04      
  2      4.7630000E+02          1.90694866646E-03      
  3      1.5440000E+02          1.02700199890E-02      
  4      5.8510000E+01          4.01902210414E-02      
  5      2.4400000E+01          1.18821580304E-01      
  6      1.0800000E+01          2.51840736623E-01      
  7      4.9130000E+00          3.66123613771E-01      
  8      2.2690000E+00          3.15433023301E-01      
P   8
  1      2.0100000E+03         -5.23795938888E-05      
  2      4.7630000E+02         -4.53032020670E-04      
  3      1.5440000E+02         -2.43076629422E-03      
  4      5.8510000E+01         -9.68736753762E-03      
  5      2.4400000E+01         -2.89720221656E-02      
  6      1.0800000E+01         -6.37358589066E-02      
  7      4.9130000E+00         -9.38158061241E-02      
  8      2.2690000E+00         -9.26433265276E-02      
P   1
  1      1.0430000E+00          1.0000000        
P   1
  1      4.3130000E-01          1.0000000        
P   1
  1      1.7670000E-01          1.0000000        
P   1
  1      7.0090000E-02          1.0000000        
D   1
  1      2.6560000E+00          1.0000000        
D   1
  1      1.0540000E+00          1.0000000        
D   1
  1      4.1800000E-01          1.0000000        
D   1
  1      1.6600000E-01          1.0000000        
F   1
  1      9.2300000E-01          1.0000000        
F   1
  1      4.5000000E-01          1.0000000        
F   1
  1      2.1900000E-01          1.0000000        
G   1
  1      9.0300000E-01          1.0000000        
G   1
  1      4.1200000E-01          1.0000000        
H   1
  1      7.4500000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: S
data:
SULFUR
S   16
  1      5.4810000E+06          1.97537386482E-06      
  2      8.2060000E+05          1.52775477832E-05      
  3      1.8670000E+05          8.00268098700E-05      
  4      5.2880000E+04          3.36353285516E-04      
  5      1.7250000E+04          1.22187980198E-03      
  6      6.2260000E+03          3.96020935726E-03      
  7      2.4290000E+03          1.17145217401E-02      
  8      1.0070000E+03          3.16420349144E-02      
  9      4.3950000E+02          7.70293600727E-02      
 10      1.9980000E+02          1.63309754458E-01      
 11      9.3920000E+01          2.79280907629E-01      
 12      4.5340000E+01          3.31785023976E-01      
 13      2.2150000E+01          2.08192341746E-01      
 14      1.0340000E+01          4.11216825495E-02      
 15      5.1190000E+00         -4.42595503421E-04      
 16      2.5530000E+00          1.66563176510E-03      
S   16
  1      5.4810000E+06         -5.48528836736E-07      
  2      8.2060000E+05         -4.24374505872E-06      
  3      1.8670000E+05         -2.22230169926E-05      
  4      5.2880000E+04         -9.34931817481E-05      
  5      1.7250000E+04         -3.39760811680E-04      
  6      6.2260000E+03         -1.10522068689E-03      
  7      2.4290000E+03         -3.28772786965E-03      
  8      1.0070000E+03         -9.02812675007E-03      
  9      4.3950000E+02         -2.26748432651E-02      
 10      1.9980000E+02         -5.15220081716E-02      
 11      9.3920000E+01         -1.00636989952E-01      
 12      4.5340000E+01         -1.56514393728E-01      
 13      2.2150000E+01         -1.37365707068E-01      
 14      1.0340000E+01          8.50908472545E-02      
 15      5.1190000E+00          4.32879074600E-01      
 16      2.5530000E+00          4.78833696807E-01      
S   16
  1      5.4810000E+06          1.59428158999E-07      
  2      8.2060000E+05          1.23271882432E-06      
  3      1.8670000E+05          6.46085076311E-06      
  4      5.2880000E+04          2.71516800850E-05      
  5      1.7250000E+04          9.88200822804E-05      
  6      6.2260000E+03          3.20981603114E-04      
  7      2.4290000E+03          9.57404044953E-04      
  8      1.0070000E+03          2.62616430582E-03      
  9      4.3950000E+02          6.63539118992E-03      
 10      1.9980000E+02          1.51162154817E-02      
 11      9.3920000E+01          3.00495764702E-02      
 12      4.5340000E+01          4.76595853885E-02      
 13      2.2150000E+01          4.42082189431E-02      
 14      1.0340000E+01         -3.08705909995E-02      
 15      5.1190000E+00         -1.70435316204E-01      
 16      2.5530000E+00         -3.11080653373E-01      
S   1
  1      1.2820000E+00          1.0000000        
S   1
  1      5.4500000E-01          1.0000000        
S   1
  1      2.4110000E-01          1.0000000        
S   1
  1      1.0350000E-01          1.0000000        
P   8
  1      2.2000000E+03          2.47310968880E-04      
  2      5.2140000E+02          2.11651521282E-03      
  3      1.6900000E+02          1.13571183514E-02      
  4      6.4050000E+01          4.43280741619E-02      
  5      2.6720000E+01          1.29488838013E-01      
  6      1.1830000E+01          2.69105831392E-01      
  7      5.3780000E+00          3.78065324724E-01      
  8      2.4820000E+00          2.95938626640E-01      
P   8
  1      2.2000000E+03         -6.29553047201E-05      
  2      5.2140000E+02         -5.40400204084E-04      
  3      1.6900000E+02         -2.90981696384E-03      
  4      6.4050000E+01         -1.15032072407E-02      
  5      2.6720000E+01         -3.43497893603E-02      
  6      1.1830000E+01         -7.35097060841E-02      
  7      5.3780000E+00         -1.07592751746E-01      
  8      2.4820000E+00         -8.73009092136E-02      
P   1
  1      1.1160000E+00          1.0000000        
P   1
  1      4.8480000E-01          1.0000000        
P   1
  1      2.0060000E-01          1.0000000        
P   1
  1      7.9510000E-02          1.0000000        
D   1
  1      3.2030000E+00          1.0000000        
D   1
  1      1.2810000E+00          1.0000000        
D   1
  1      5.1200000E-01          1.0000000        
D   1
  1      2.0500000E-01          1.0000000        
F   1
  1      1.0960000E+00          1.0000000        
F   1
  1      5.2900000E-01          1.0000000        
F   1
  1      2.5500000E-01          1.0000000        
G   1
  1      1.0710000E+00          1.0000000        
G   1
  1      4.6300000E-01          1.0000000        
H   1
  1      8.7200000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   16
  1      6.4100000E+06          1.90273115755E-06      
  2      9.5960000E+05          1.47176793119E-05      
  3      2.1830000E+05          7.69826021899E-05      
  4      6.1810000E+04          3.24092149525E-04      
  5      2.0140000E+04          1.17727440224E-03      
  6      7.2640000E+03          3.82248181465E-03      
  7      2.8320000E+03          1.12933474230E-02      
  8      1.1750000E+03          3.05201789793E-02      
  9      5.1260000E+02          7.45744994571E-02      
 10      2.3300000E+02          1.58958427083E-01      
 11      1.0950000E+02          2.74749982848E-01      
 12      5.2860000E+01          3.32577560990E-01      
 13      2.5840000E+01          2.15697053089E-01      
 14      1.2170000E+01          4.51451911547E-02      
 15      6.0300000E+00         -1.30673456241E-04      
 16      3.0120000E+00          1.61412207262E-03      
S   16
  1      6.4100000E+06         -5.36591315047E-07      
  2      9.5960000E+05         -4.15168948564E-06      
  3      2.1830000E+05         -2.17114307392E-05      
  4      6.1810000E+04         -9.14803783475E-05      
  5      2.0140000E+04         -3.32471509580E-04      
  6      7.2640000E+03         -1.08319203934E-03      
  7      2.8320000E+03         -3.21853904843E-03      
  8      1.1750000E+03         -8.83730548164E-03      
  9      5.1260000E+02         -2.22699346036E-02      
 10      2.3300000E+02         -5.07846730558E-02      
 11      1.0950000E+02         -1.00026238394E-01      
 12      5.2860000E+01         -1.57358985516E-01      
 13      2.5840000E+01         -1.43373606056E-01      
 14      1.2170000E+01          7.38998235168E-02      
 15      6.0300000E+00          4.32842054036E-01      
 16      3.0120000E+00          4.87478455390E-01      
S   16
  1      6.4100000E+06          1.62409477444E-07      
  2      9.5960000E+05          1.25597300513E-06      
  3      2.1830000E+05          6.57295096919E-06      
  4      6.1810000E+04          2.76696980813E-05      
  5      2.0140000E+04          1.00691669035E-04      
  6      7.2640000E+03          3.27657985883E-04      
  7      2.8320000E+03          9.75912390982E-04      
  8      1.1750000E+03          2.67774868616E-03      
  9      5.1260000E+02          6.78570885381E-03      
 10      2.3300000E+02          1.55252061216E-02      
 11      1.0950000E+02          3.11046056608E-02      
 12      5.2860000E+01          4.99813962712E-02      
 13      2.5840000E+01          4.80727114752E-02      
 14      1.2170000E+01         -2.79419320498E-02      
 15      6.0300000E+00         -1.80106043650E-01      
 16      3.0120000E+00         -3.31911076216E-01      
S   1
  1      1.5110000E+00          1.0000000        
S   1
  1      6.6040000E-01          1.0000000        
S   1
  1      2.9260000E-01          1.0000000        
S   1
  1      1.2540000E-01          1.0000000        
P   8
  1      2.5480000E+03          2.45075946821E-04      
  2      6.0370000E+02          2.09697573121E-03      
  3      1.9560000E+02          1.12950786825E-02      
  4      7.4150000E+01          4.42902544455E-02      
  5      3.0940000E+01          1.30393320333E-01      
  6      1.3690000E+01          2.73032830748E-01      
  7      6.2290000E+00          3.83087918765E-01      
  8      2.8780000E+00          2.90899593147E-01      
P   8
  1      2.5480000E+03         -6.60801026687E-05      
  2      6.0370000E+02         -5.65584502019E-04      
  3      1.9560000E+02         -3.06666701207E-03      
  4      7.4150000E+01         -1.21502321580E-02      
  5      3.0940000E+01         -3.67431802405E-02      
  6      1.3690000E+01         -7.90491509800E-02      
  7      6.2290000E+00         -1.17163195787E-01      
  8      2.8780000E+00         -8.54454303645E-02      
P   1
  1      1.2820000E+00          1.0000000        
P   1
  1      5.6410000E-01          1.0000000        
P   1
  1      2.3480000E-01          1.0000000        
P   1
  1      9.3120000E-02          1.0000000        
D   1
  1      3.7810000E+00          1.0000000        
D   1
  1      1.5290000E+00          1.0000000        
D   1
  1      6.1800000E-01          1.0000000        
D   1
  1      2.5000000E-01          1.0000000        
F   1
  1      1.3450000E+00          1.0000000        
F   1
  1      6.5600000E-01          1.0000000        
F   1
  1      3.2000000E-01          1.0000000        
G   1
  1      1.3020000E+00          1.0000000        
G   1
  1      5.5600000E-01          1.0000000        
H   1
  1      1.0530000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ar
data:
ARGON
S   16
  1      7.4010000E+06          1.84725492603E-06      
  2      1.1080000E+06          1.42737385086E-05      
  3      2.5210000E+05          7.46120027575E-05      
  4      7.1380000E+04          3.13872040631E-04      
  5      2.3260000E+04          1.13968519166E-03      
  6      8.3900000E+03          3.69788328522E-03      
  7      3.2710000E+03          1.09304597085E-02      
  8      1.3570000E+03          2.95516873965E-02      
  9      5.9200000E+02          7.23921786359E-02      
 10      2.6910000E+02          1.54936159486E-01      
 11      1.2650000E+02          2.70462922537E-01      
 12      6.1030000E+01          3.33238332206E-01      
 13      2.9860000E+01          2.22191230020E-01      
 14      1.4170000E+01          4.92979861411E-02      
 15      7.0220000E+00          6.32246226011E-05      
 16      3.5110000E+00          1.65829970806E-03      
S   16
  1      7.4010000E+06         -5.28079450202E-07      
  2      1.1080000E+06         -4.08127328654E-06      
  3      2.5210000E+05         -2.13317778214E-05      
  4      7.1380000E+04         -8.97981736121E-05      
  5      2.3260000E+04         -3.26282330198E-04      
  6      8.3900000E+03         -1.06199593096E-03      
  7      3.2710000E+03         -3.15756223945E-03      
  8      1.3570000E+03         -8.66794386347E-03      
  9      5.9200000E+02         -2.18940426469E-02      
 10      2.6910000E+02         -5.00424179470E-02      
 11      1.2650000E+02         -9.93429064047E-02      
 12      6.1030000E+01         -1.58023503024E-01      
 13      2.9860000E+01         -1.48485762315E-01      
 14      1.4170000E+01          6.35653629472E-02      
 15      7.0220000E+00          4.32324444443E-01      
 16      3.5110000E+00          4.95267477525E-01      
S   16
  1      7.4010000E+06          1.65101966181E-07      
  2      1.1080000E+06          1.27547331430E-06      
  3      2.5210000E+05          6.67066127908E-06      
  4      7.1380000E+04          2.80595699379E-05      
  5      2.3260000E+04          1.02067316657E-04      
  6      8.3900000E+03          3.31891920451E-04      
  7      3.2710000E+03          9.88877747493E-04      
  8      1.3570000E+03          2.71369837957E-03      
  9      5.9200000E+02          6.89030295110E-03      
 10      2.6910000E+02          1.58103105530E-02      
 11      1.2650000E+02          3.19098226593E-02      
 12      6.1030000E+01          5.19163923404E-02      
 13      2.9860000E+01          5.14383553040E-02      
 14      1.4170000E+01         -2.48212419659E-02      
 15      7.0220000E+00         -1.88169455022E-01      
 16      3.5110000E+00         -3.49466530433E-01      
S   1
  1      1.7580000E+00          1.0000000        
S   1
  1      7.8410000E-01          1.0000000        
S   1
  1      3.4800000E-01          1.0000000        
S   1
  1      1.4910000E-01          1.0000000        
P   8
  1      2.9270000E+03          2.42506033585E-04      
  2      6.9350000E+02          2.07449264455E-03      
  3      2.2470000E+02          1.11946939572E-02      
  4      8.5170000E+01          4.41978634173E-02      
  5      3.5530000E+01          1.30833411640E-01      
  6      1.5730000E+01          2.75860031672E-01      
  7      7.1650000E+00          3.86939879224E-01      
  8      3.3220000E+00          2.86254194396E-01      
P   8
  1      2.9270000E+03         -6.78700613488E-05      
  2      6.9350000E+02         -5.79791772476E-04      
  3      2.2470000E+02         -3.15608293840E-03      
  4      8.5170000E+01         -1.25737675564E-02      
  5      3.5530000E+01         -3.83629597304E-02      
  6      1.5730000E+01         -8.30629583164E-02      
  7      7.1650000E+00         -1.24283705526E-01      
  8      3.3220000E+00         -8.24657432232E-02      
P   1
  1      1.4780000E+00          1.0000000        
P   1
  1      6.5520000E-01          1.0000000        
P   1
  1      2.7510000E-01          1.0000000        
P   1
  1      1.0970000E-01          1.0000000        
D   1
  1      4.7760000E+00          1.0000000        
D   1
  1      1.9170000E+00          1.0000000        
D   1
  1      7.7000000E-01          1.0000000        
D   1
  1      3.0900000E-01          1.0000000        
F   1
  1      1.6680000E+00          1.0000000        
F   1
  1      8.2500000E-01          1.0000000        
F   1
  1      4.0800000E-01          1.0000000        
G   1
  1      1.5620000E+00          1.0000000        
G   1
  1      6.6500000E-01          1.0000000        
H   1
  1      1.2640000E+00          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ga
data:
GALLIUM
S   22
  1      1.0861522E+08          2.87265538283E-07      
  2      1.6264540E+07          2.18976026142E-06      
  3      3.7001116E+06          1.13122869010E-05      
  4      1.0471691E+06          4.71260718466E-05      
  5      3.4106757E+05          1.70000908973E-04      
  6      1.2277154E+05          5.52103278219E-04      
  7      4.7659578E+04          1.65214659481E-03      
  8      1.9633354E+04          4.61934441206E-03      
  9      8.4887347E+03          1.21351258754E-02      
 10      3.8231381E+03          2.98645156897E-02      
 11      1.7844755E+03          6.78053651735E-02      
 12      8.6005305E+02          1.37583444036E-01      
 13      4.2669867E+02          2.35193126434E-01      
 14      2.1726161E+02          3.04303617198E-01      
 15      1.1296987E+02          2.46666079455E-01      
 16      5.9449441E+01          9.24097360846E-02      
 17      3.0782256E+01          9.29439130087E-03      
 18      1.6423212E+01          5.66805709524E-04      
 19      8.7578890E+00         -5.91143923874E-05      
 20      4.4096290E+00          1.28979321478E-05      
 21      2.2494490E+00         -6.21947567103E-05      
 22      1.1261150E+00          1.65303992997E-05      
S   22
  1      1.0861522E+08         -9.09812759881E-08      
  2      1.6264540E+07         -6.93465465314E-07      
  3      3.7001116E+06         -3.58330605004E-06      
  4      1.0471691E+06         -1.49262772583E-05      
  5      3.4106757E+05         -5.38777367382E-05      
  6      1.2277154E+05         -1.75035045544E-04      
  7      4.7659578E+04         -5.24844777685E-04      
  8      1.9633354E+04         -1.47176805199E-03      
  9      8.4887347E+03         -3.89747526228E-03      
 10      3.8231381E+03         -9.73418116246E-03      
 11      1.7844755E+03         -2.28208887063E-02      
 12      8.6005305E+02         -4.91644691278E-02      
 13      4.2669867E+02         -9.44799610699E-02      
 14      2.1726161E+02         -1.50261589629E-01      
 15      1.1296987E+02         -1.65691927703E-01      
 16      5.9449441E+01         -2.84972954036E-02      
 17      3.0782256E+01          3.12852574078E-01      
 18      1.6423212E+01          5.22460776850E-01      
 19      8.7578890E+00          2.85241305723E-01      
 20      4.4096290E+00          4.11290515530E-02      
 21      2.2494490E+00          1.31492122742E-03      
 22      1.1261150E+00          1.07314902034E-03      
S   22
  1      1.0861522E+08          3.48225035276E-08      
  2      1.6264540E+07          2.65381877110E-07      
  3      3.7001116E+06          1.37159676640E-06      
  4      1.0471691E+06          5.71186428853E-06      
  5      3.4106757E+05          2.06257424187E-05      
  6      1.2277154E+05          6.69841317670E-05      
  7      4.7659578E+04          2.00998632786E-04      
  8      1.9633354E+04          5.63536375887E-04      
  9      8.4887347E+03          1.49479957082E-03      
 10      3.8231381E+03          3.73753591631E-03      
 11      1.7844755E+03          8.80560251395E-03      
 12      8.6005305E+02          1.90967583226E-02      
 13      4.2669867E+02          3.73123873854E-02      
 14      2.1726161E+02          6.09432971431E-02      
 15      1.1296987E+02          7.06839833947E-02      
 16      5.9449441E+01          1.19794687249E-02      
 17      3.0782256E+01         -1.72760447186E-01      
 18      1.6423212E+01         -4.04805287223E-01      
 19      8.7578890E+00         -2.72454982982E-01      
 20      4.4096290E+00          2.96379068853E-01      
 21      2.2494490E+00          6.35358575574E-01      
 22      1.1261150E+00          3.50266144612E-01      
S   22
  1      1.0861522E+08         -8.16825054465E-09      
  2      1.6264540E+07         -6.22541963797E-08      
  3      3.7001116E+06         -3.21723670593E-07      
  4      1.0471691E+06         -1.33995599146E-06      
  5      3.4106757E+05         -4.83787591198E-06      
  6      1.2277154E+05         -1.57147563347E-05      
  7      4.7659578E+04         -4.71452817038E-05      
  8      1.9633354E+04         -1.32224487803E-04      
  9      8.4887347E+03         -3.50661340512E-04      
 10      3.8231381E+03         -8.77331757047E-04      
 11      1.7844755E+03         -2.06717574455E-03      
 12      8.6005305E+02         -4.49010063887E-03      
 13      4.2669867E+02         -8.78487234949E-03      
 14      2.1726161E+02         -1.44170908921E-02      
 15      1.1296987E+02         -1.67996737171E-02      
 16      5.9449441E+01         -2.90841863229E-03      
 17      3.0782256E+01          4.27062061878E-02      
 18      1.6423212E+01          1.04633262713E-01      
 19      8.7578890E+00          7.22833216156E-02      
 20      4.4096290E+00         -9.38629898802E-02      
 21      2.2494490E+00         -2.28697249719E-01      
 22      1.1261150E+00         -2.47677628528E-01      
S   1
  1      5.1548600E-01          1.0000000        
S   1
  1      2.4257800E-01          1.0000000        
S   1
  1      1.0708600E-01          1.0000000        
S   1
  1      4.6988000E-02          1.0000000        
P   13
  1      3.2152190E+04          3.52460818657E-05      
  2      7.6093842E+03          2.87839858396E-04      
  3      2.4714744E+03          1.59754791866E-03      
  4      9.4606363E+02          6.94181071513E-03      
  5      4.0194711E+02          2.46903931140E-02      
  6      1.8364688E+02          7.24816099694E-02      
  7      8.8533264E+01          1.69321684074E-01      
  8      4.4270355E+01          2.96109157544E-01      
  9      2.2723083E+01          3.45832056015E-01      
 10      1.1823141E+01          2.13410835379E-01      
 11      6.0421350E+00          5.03034826132E-02      
 12      3.0317540E+00          2.97490395937E-03      
 13      1.4933660E+00          6.65111838320E-04      
P   13
  1      3.2152190E+04         -1.34261259897E-05      
  2      7.6093842E+03         -1.09594204305E-04      
  3      2.4714744E+03         -6.10562032301E-04      
  4      9.4606363E+02         -2.66321065374E-03      
  5      4.0194711E+02         -9.59354985500E-03      
  6      1.8364688E+02         -2.87662708346E-02      
  7      8.8533264E+01         -6.98267762736E-02      
  8      4.4270355E+01         -1.27719455346E-01      
  9      2.2723083E+01         -1.56843159901E-01      
 10      1.1823141E+01         -3.74709564148E-02      
 11      6.0421350E+00          2.49045471677E-01      
 12      3.0317540E+00          4.46494230568E-01      
 13      1.4933660E+00          3.48251823376E-01      
P   13
  1      3.2152190E+04          2.17863350811E-06      
  2      7.6093842E+03          1.79742634840E-05      
  3      2.4714744E+03          9.90669571900E-05      
  4      9.4606363E+02          4.37156887588E-04      
  5      4.0194711E+02          1.55888270167E-03      
  6      1.8364688E+02          4.74124270711E-03      
  7      8.8533264E+01          1.13963587610E-02      
  8      4.4270355E+01          2.13297925993E-02      
  9      2.2723083E+01          2.55576654978E-02      
 10      1.1823141E+01          5.72714907253E-03      
 11      6.0421350E+00         -5.10621306104E-02      
 12      3.0317540E+00         -8.42036459509E-02      
 13      1.4933660E+00         -8.93316264200E-02      
P   1
  1      7.0972700E-01          1.0000000        
P   1
  1      2.4859300E-01          1.0000000        
P   1
  1      9.4395000E-02          1.0000000        
P   1
  1      3.5887000E-02          1.0000000        
D   9
  1      1.0405046E+03          9.22895791809E-05      
  2      3.1459714E+02          8.75253387520E-04      
  3      1.2278760E+02          5.03218186451E-03      
  4      5.4760369E+01          1.98906756974E-02      
  5      2.6298944E+01          5.79235711916E-02      
  6      1.3263445E+01          1.30757102761E-01      
  7      6.8850650E+00          2.20471160305E-01      
  8      3.5795250E+00          2.81277075664E-01      
  9      1.8315640E+00          2.83043866308E-01      
D   1
  1      9.1290900E-01          1.0000000        
D   1
  1      4.3534000E-01          1.0000000        
D   1
  1      1.8851800E-01          1.0000000        
D   1
  1      7.5800000E-02          1.0000000        
F   1
  1      5.9600000E-01          1.0000000        
F   1
  1      2.8260000E-01          1.0000000        
F   1
  1      1.3400000E-01          1.0000000        
G   1
  1      6.1460000E-01          1.0000000        
G   1
  1      2.7500000E-01          1.0000000        
H   1
  1      4.9860000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   22
  1      1.2200119E+08          2.72592102115E-07      
  2      1.8257470E+07          2.07713900939E-06      
  3      4.1508215E+06          1.07262230057E-05      
  4      1.1741018E+06          4.46602243880E-05      
  5      3.8230915E+05          1.60969958455E-04      
  6      1.3760796E+05          5.22311420895E-04      
  7      5.3419242E+04          1.56185848831E-03      
  8      2.2005756E+04          4.36516809812E-03      
  9      9.5138479E+03          1.14693509224E-02      
 10      4.2841756E+03          2.82626552884E-02      
 11      1.9991664E+03          6.43792891703E-02      
 12      9.6324716E+02          1.31507772932E-01      
 13      4.7780500E+02          2.27634842140E-01      
 14      2.4331589E+02          3.01489329979E-01      
 15      1.2663999E+02          2.55055182567E-01      
 16      6.6783579E+01          1.03437270189E-01      
 17      3.4416084E+01          1.19561645860E-02      
 18      1.8372814E+01          3.77488513628E-04      
 19      9.8054610E+00          6.86244958520E-05      
 20      4.9694030E+00         -4.57517977246E-05      
 21      2.5486230E+00         -3.18753424102E-05      
 22      1.2845940E+00         -2.35687359836E-07      
S   22
  1      1.2200119E+08         -8.67591541644E-08      
  2      1.8257470E+07         -6.61024322737E-07      
  3      4.1508215E+06         -3.41443816099E-06      
  4      1.1741018E+06         -1.42144312626E-05      
  5      3.8230915E+05         -5.12677975924E-05      
  6      1.3760796E+05         -1.66393137310E-04      
  7      5.3419242E+04         -4.98585406069E-04      
  8      2.2005756E+04         -1.39723972203E-03      
  9      9.5138479E+03         -3.70002282461E-03      
 10      4.2841756E+03         -9.24541911568E-03      
 11      1.9991664E+03         -2.17197140635E-02      
 12      9.6324716E+02         -4.69699138589E-02      
 13      4.7780500E+02         -9.09538517790E-02      
 14      2.4331589E+02         -1.46726000716E-01      
 15      1.2663999E+02         -1.68128802276E-01      
 16      6.6783579E+01         -4.50168746728E-02      
 17      3.4416084E+01          2.89113425891E-01      
 18      1.8372814E+01          5.23611331943E-01      
 19      9.8054610E+00          3.07010280240E-01      
 20      4.9694030E+00          4.85825093037E-02      
 21      2.5486230E+00          1.47138549650E-03      
 22      1.2845940E+00          1.19503738295E-03      
S   22
  1      1.2200119E+08          3.35532127427E-08      
  2      1.8257470E+07          2.55610077338E-07      
  3      4.1508215E+06          1.32060005940E-06      
  4      1.1741018E+06          5.49631360969E-06      
  5      3.8230915E+05          1.98313771343E-05      
  6      1.3760796E+05          6.43426008235E-05      
  7      5.3419242E+04          1.92932496992E-04      
  8      2.2005756E+04          5.40584739725E-04      
  9      9.5138479E+03          1.43379493058E-03      
 10      4.2841756E+03          3.58660345006E-03      
 11      1.9991664E+03          8.46589181613E-03      
 12      9.6324716E+02          1.84258326632E-02      
 13      4.7780500E+02          3.62547116737E-02      
 14      2.4331589E+02          6.00098871041E-02      
 15      1.2663999E+02          7.22272299073E-02      
 16      6.6783579E+01          1.97250559187E-02      
 17      3.4416084E+01         -1.59794389701E-01      
 18      1.8372814E+01         -4.01178251859E-01      
 19      9.8054610E+00         -2.99814063226E-01      
 20      4.9694030E+00          2.61625922446E-01      
 21      2.5486230E+00          6.43370635822E-01      
 22      1.2845940E+00          3.74792303720E-01      
S   22
  1      1.2200119E+08         -8.67070954562E-09      
  2      1.8257470E+07         -6.60506410926E-08      
  3      4.1508215E+06         -3.41273630390E-07      
  4      1.1741018E+06         -1.42023882242E-06      
  5      3.8230915E+05         -5.12506199514E-06      
  6      1.3760796E+05         -1.66258503909E-05      
  7      5.3419242E+04         -4.98633446194E-05      
  8      2.2005756E+04         -1.39692248871E-04      
  9      9.5138479E+03         -3.70644495988E-04      
 10      4.2841756E+03         -9.27133715192E-04      
 11      1.9991664E+03         -2.19031758306E-03      
 12      9.6324716E+02         -4.77023450767E-03      
 13      4.7780500E+02         -9.40967460092E-03      
 14      2.4331589E+02         -1.56243546361E-02      
 15      1.2663999E+02         -1.89484977340E-02      
 16      6.6783579E+01         -5.18343148500E-03      
 17      3.4416084E+01          4.33851320020E-02      
 18      1.8372814E+01          1.14666823555E-01      
 19      9.8054610E+00          8.77361204340E-02      
 20      4.9694030E+00         -9.09376442055E-02      
 21      2.5486230E+00         -2.58963192915E-01      
 22      1.2845940E+00         -2.89798941260E-01      
S   1
  1      5.8335300E-01          1.0000000        
S   1
  1      2.9343900E-01          1.0000000        
S   1
  1      1.3267200E-01          1.0000000        
S   1
  1      5.9239000E-02          1.0000000        
P   13
  1      3.2314970E+04          3.96565266949E-05      
  2      7.6482002E+03          3.22695489960E-04      
  3      2.4842114E+03          1.78534104806E-03      
  4      9.5100305E+02          7.72500684791E-03      
  5      4.0404833E+02          2.73112499366E-02      
  6      1.8460354E+02          7.93705799157E-02      
  7      8.8964128E+01          1.82135048314E-01      
  8      4.4447742E+01          3.09408641624E-01      
  9      2.2799075E+01          3.41844720980E-01      
 10      1.1835928E+01          1.92033948804E-01      
 11      6.0112940E+00          3.92806325687E-02      
 12      2.9957840E+00          1.97791265807E-03      
 13      1.4695700E+00          4.43771290714E-04      
P   13
  1      3.2314970E+04         -1.53364250180E-05      
  2      7.6482002E+03         -1.24772318514E-04      
  3      2.4842114E+03         -6.92908605912E-04      
  4      9.5100305E+02         -3.01141670006E-03      
  5      4.0404833E+02         -1.07899079008E-02      
  6      1.8460354E+02         -3.20860917803E-02      
  7      8.8964128E+01         -7.66116331807E-02      
  8      4.4447742E+01         -1.36502019170E-01      
  9      2.2799075E+01         -1.56624691628E-01      
 10      1.1835928E+01         -9.18847578764E-03      
 11      6.0112940E+00          2.91789311964E-01      
 12      2.9957840E+00          4.62070730432E-01      
 13      1.4695700E+00          3.11379779324E-01      
P   13
  1      3.2314970E+04          2.99362422413E-06      
  2      7.6482002E+03          2.44527506325E-05      
  3      2.4842114E+03          1.35283023021E-04      
  4      9.5100305E+02          5.90724976744E-04      
  5      4.0404833E+02          2.11048896298E-03      
  6      1.8460354E+02          6.32086452886E-03      
  7      8.8964128E+01          1.50783240437E-02      
  8      4.4447742E+01          2.72147245358E-02      
  9      2.2799075E+01          3.09808070788E-02      
 10      1.1835928E+01         -3.80524594366E-04      
 11      6.0112940E+00         -7.04064321589E-02      
 12      2.9957840E+00         -1.11134275235E-01      
 13      1.4695700E+00         -9.66748452349E-02      
P   1
  1      6.9068100E-01          1.0000000        
P   1
  1      2.8616000E-01          1.0000000        
P   1
  1      1.1774200E-01          1.0000000        
P   1
  1      4.7385000E-02          1.0000000        
D   9
  1      1.2267982E+03          7.93066337511E-05      
  2      3.7123223E+02          7.56027981592E-04      
  3      1.4489099E+02          4.40627396008E-03      
  4      6.4604130E+01          1.78883830452E-02      
  5      3.1039737E+01          5.35931997353E-02      
  6      1.5643870E+01          1.24869219494E-01      
  7      8.1258220E+00          2.17778588293E-01      
  8      4.2397620E+00          2.84786699684E-01      
  9      2.1863860E+00          2.89428820695E-01      
D   1
  1      1.1038710E+00          1.0000000        
D   1
  1      5.3381100E-01          1.0000000        
D   1
  1      2.3135500E-01          1.0000000        
D   1
  1      9.5300000E-02          1.0000000        
F   1
  1      6.7090000E-01          1.0000000        
F   1
  1      3.2970000E-01          1.0000000        
F   1
  1      1.6300000E-01          1.0000000        
G   1
  1      7.0340000E-01          1.0000000        
G   1
  1      3.1600000E-01          1.0000000        
H   1
  1      5.8150000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: As
data:
ARSENIC
S   22
  1      1.3750753E+08          2.57290342112E-07      
  2      2.0515052E+07          1.96711344374E-06      
  3      4.6487164E+06          1.01898793043E-05      
  4      1.3112646E+06          4.25096845139E-05      
  5      4.2618586E+05          1.53317975203E-04      
  6      1.5323706E+05          4.97413663343E-04      
  7      5.9459404E+04          1.48632131328E-03      
  8      2.4492812E+04          4.15082717494E-03      
  9      1.0590253E+04          1.09020032349E-02      
 10      4.7697841E+03          2.68745561930E-02      
 11      2.2263698E+03          6.13366317819E-02      
 12      1.0730862E+03          1.25929553065E-01      
 13      5.3250059E+02          2.20338529988E-01      
 14      2.7129755E+02          2.98112646116E-01      
 15      1.4131195E+02          2.62419964875E-01      
 16      7.4584433E+01          1.14300232638E-01      
 17      3.8298338E+01          1.48300723618E-02      
 18      2.0469130E+01          2.00525825579E-04      
 19      1.0939578E+01          2.00741562937E-04      
 20      5.5903670E+00         -1.08658627631E-04      
 21      2.8828590E+00          1.31514568696E-06      
 22      1.4660860E+00         -1.91985616382E-05      
S   22
  1      1.3750753E+08         -8.22787921158E-08      
  2      2.0515052E+07         -6.28980374213E-07      
  3      4.6487164E+06         -3.25917401877E-06      
  4      1.3112646E+06         -1.35940529735E-05      
  5      4.2618586E+05         -4.90637700110E-05      
  6      1.5323706E+05         -1.59207306333E-04      
  7      5.9459404E+04         -4.76712946930E-04      
  8      2.4492812E+04         -1.33465440586E-03      
  9      1.0590253E+04         -3.53228976296E-03      
 10      4.7697841E+03         -8.82342652488E-03      
 11      2.2263698E+03         -2.07456452430E-02      
 12      1.0730862E+03         -4.49751762935E-02      
 13      5.3250059E+02         -8.76361019088E-02      
 14      2.7129755E+02         -1.43207801244E-01      
 15      1.4131195E+02         -1.69790482707E-01      
 16      7.4584433E+01         -5.96681583555E-02      
 17      3.8298338E+01          2.66043371214E-01      
 18      2.0469130E+01          5.22247495400E-01      
 19      1.0939578E+01          3.27704684550E-01      
 20      5.5903670E+00          5.68902761174E-02      
 21      2.8828590E+00          1.81016555189E-03      
 22      1.4660860E+00          1.29150073972E-03      
S   22
  1      1.3750753E+08          3.21542169527E-08      
  2      2.0515052E+07          2.45773591638E-07      
  3      4.6487164E+06          1.27376101721E-06      
  4      1.3112646E+06          5.31167827263E-06      
  5      4.2618586E+05          1.91776049936E-05      
  6      1.5323706E+05          6.22113373304E-05      
  7      5.9459404E+04          1.86398633473E-04      
  8      2.4492812E+04          5.21797620066E-04      
  9      1.0590253E+04          1.38305612921E-03      
 10      4.7697841E+03          3.45862067250E-03      
 11      2.2263698E+03          8.16891089602E-03      
 12      1.0730862E+03          1.78212760118E-02      
 13      5.3250059E+02          3.52621548831E-02      
 14      2.7129755E+02          5.90798500001E-02      
 15      1.4131195E+02          7.34662126213E-02      
 16      7.4584433E+01          2.67069475932E-02      
 17      3.8298338E+01         -1.47419717299E-01      
 18      2.0469130E+01         -3.96331890166E-01      
 19      1.0939578E+01         -3.25255175233E-01      
 20      5.5903670E+00          2.25395317861E-01      
 21      2.8828590E+00          6.48011777673E-01      
 22      1.4660860E+00          3.99803105939E-01      
S   22
  1      1.3750753E+08         -8.92765312032E-09      
  2      2.0515052E+07         -6.82317742126E-08      
  3      4.6487164E+06         -3.53680122713E-07      
  4      1.3112646E+06         -1.47455494186E-06      
  5      4.2618586E+05         -5.32532590036E-06      
  6      1.5323706E+05         -1.72694700196E-05      
  7      5.9459404E+04         -5.17655640524E-05      
  8      2.4492812E+04         -1.44849792935E-04      
  9      1.0590253E+04         -3.84195306540E-04      
 10      4.7697841E+03         -9.60392514696E-04      
 11      2.2263698E+03         -2.27126742047E-03      
 12      1.0730862E+03         -4.95569404959E-03      
 13      5.3250059E+02         -9.83663653013E-03      
 14      2.7129755E+02         -1.65187067213E-02      
 15      1.4131195E+02         -2.07280497195E-02      
 16      7.4584433E+01         -7.51800601373E-03      
 17      3.8298338E+01          4.29282021597E-02      
 18      2.0469130E+01          1.21990870141E-01      
 19      1.0939578E+01          1.02612038334E-01      
 20      5.5903670E+00         -8.40624559123E-02      
 21      2.8828590E+00         -2.82788527499E-01      
 22      1.4660860E+00         -3.27785814409E-01      
S   1
  1      6.7483900E-01          1.0000000        
S   1
  1      3.4639900E-01          1.0000000        
S   1
  1      1.5928900E-01          1.0000000        
S   1
  1      7.2109000E-02          1.0000000        
P   13
  1      3.4166161E+04          4.08667478263E-05      
  2      8.0865608E+03          3.30889441787E-04      
  3      2.6265114E+03          1.82591070562E-03      
  4      1.0053950E+03          7.88806966656E-03      
  5      4.2712735E+02          2.78556968402E-02      
  6      1.9515113E+02          8.08171141115E-02      
  7      9.4054308E+01          1.84893762158E-01      
  8      4.6999880E+01          3.12306551110E-01      
  9      2.4117457E+01          3.40543779280E-01      
 10      1.2519982E+01          1.87070994366E-01      
 11      6.3573250E+00          3.70177865487E-02      
 12      3.1680520E+00          1.78462544156E-03      
 13      1.5534810E+00          3.25866701313E-04      
P   13
  1      3.4166161E+04         -1.60418044606E-05      
  2      8.0865608E+03         -1.29892452926E-04      
  3      2.6265114E+03         -7.19362918084E-04      
  4      1.0053950E+03         -3.12248982543E-03      
  5      4.2712735E+02         -1.11755982211E-02      
  6      1.9515113E+02         -3.32003840358E-02      
  7      9.4054308E+01         -7.90603076432E-02      
  8      4.6999880E+01         -1.40261280076E-01      
  9      2.4117457E+01         -1.57910140316E-01      
 10      1.2519982E+01         -1.28124992422E-03      
 11      6.3573250E+00          3.06005756825E-01      
 12      3.1680520E+00          4.70276569530E-01      
 13      1.5534810E+00          2.97187650215E-01      
P   13
  1      3.4166161E+04          3.54074603642E-06      
  2      8.0865608E+03          2.86732483610E-05      
  3      2.6265114E+03          1.58843759923E-04      
  4      1.0053950E+03          6.89944485097E-04      
  5      4.2712735E+02          2.47289302557E-03      
  6      1.9515113E+02          7.36774723846E-03      
  7      9.4054308E+01          1.76250593975E-02      
  8      4.6999880E+01          3.14754055279E-02      
  9      2.4117457E+01          3.55774558347E-02      
 10      1.2519982E+01         -3.32904646383E-03      
 11      6.3573250E+00         -8.29100346024E-02      
 12      3.1680520E+00         -1.33857172141E-01      
 13      1.5534810E+00         -1.00212106346E-01      
P   1
  1      7.1032500E-01          1.0000000        
P   1
  1      3.2095500E-01          1.0000000        
P   1
  1      1.3935700E-01          1.0000000        
P   1
  1      5.8410000E-02          1.0000000        
D   9
  1      1.4244506E+03          6.96780190312E-05      
  2      4.3106676E+02          6.67869103384E-04      
  3      1.6812864E+02          3.94109445148E-03      
  4      7.4866724E+01          1.63852512475E-02      
  5      3.5945855E+01          5.03487288394E-02      
  6      1.8098474E+01          1.20324778833E-01      
  7      9.4057800E+00          2.15463926336E-01      
  8      4.9239040E+00          2.87431543735E-01      
  9      2.5564930E+00          2.94489228970E-01      
D   1
  1      1.3042330E+00          1.0000000        
D   1
  1      6.3711800E-01          1.0000000        
D   1
  1      2.7579500E-01          1.0000000        
D   1
  1      1.1530000E-01          1.0000000        
F   1
  1      7.5990000E-01          1.0000000        
F   1
  1      3.8590000E-01          1.0000000        
F   1
  1      1.9600000E-01          1.0000000        
G   1
  1      8.0920000E-01          1.0000000        
G   1
  1      3.7000000E-01          1.0000000        
H   1
  1      6.7730000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Se
data:
SELENIUM
S   22
  1      1.5443225E+08          2.42889535002E-07      
  2      2.3129212E+07          1.84363648396E-06      
  3      5.2617929E+06          9.48831752173E-06      
  4      1.4888167E+06          3.94147464796E-05      
  5      4.8465656E+05          1.41913054160E-04      
  6      1.7427063E+05          4.60636662238E-04      
  7      6.7529090E+04          1.37975360188E-03      
  8      2.7750837E+04          3.86654322138E-03      
  9      1.1964216E+04          1.01987735031E-02      
 10      5.3707148E+03          2.52880785754E-02      
 11      2.4973194E+03          5.81844904269E-02      
 12      1.1987679E+03          1.20738208734E-01      
 13      5.9258026E+02          2.14240630208E-01      
 14      3.0097708E+02          2.95830273939E-01      
 15      1.5646024E+02          2.69129426260E-01      
 16      8.2476086E+01          1.23842819397E-01      
 17      4.2270887E+01          1.75117407882E-02      
 18      2.2630220E+01          8.03588480145E-05      
 19      1.2122374E+01          3.10137895854E-04      
 20      6.2491700E+00         -1.62378717556E-04      
 21      3.2426780E+00          3.00524598159E-05      
 22      1.6663620E+00         -3.64881160800E-05      
S   22
  1      1.5443225E+08         -7.80322391052E-08      
  2      2.3129212E+07         -5.92217042797E-07      
  3      5.2617929E+06         -3.04881097950E-06      
  4      1.4888167E+06         -1.26623658425E-05      
  5      4.8465656E+05         -4.56235630156E-05      
  6      1.7427063E+05         -1.48108993699E-04      
  7      6.7529090E+04         -4.44531379985E-04      
  8      2.7750837E+04         -1.24863029694E-03      
  9      1.1964216E+04         -3.31767265679E-03      
 10      5.3707148E+03         -8.32978983609E-03      
 11      2.4973194E+03         -1.97182718076E-02      
 12      1.1987679E+03         -4.31037611678E-02      
 13      5.9258026E+02         -8.48252799551E-02      
 14      3.0097708E+02         -1.40524972614E-01      
 15      1.5646024E+02         -1.71266703188E-01      
 16      8.2476086E+01         -7.13980611721E-02      
 17      4.2270887E+01          2.46368452288E-01      
 18      2.2630220E+01          5.18855831227E-01      
 19      1.2122374E+01          3.45085926454E-01      
 20      6.2491700E+00          6.52648072258E-02      
 21      3.2426780E+00          2.25422052936E-03      
 22      1.6663620E+00          1.38148761646E-03      
S   22
  1      1.5443225E+08          3.08086382232E-08      
  2      2.3129212E+07          2.33793790204E-07      
  3      5.2617929E+06          1.20380736768E-06      
  4      1.4888167E+06          4.99866633609E-06      
  5      4.8465656E+05          1.80162859172E-05      
  6      1.7427063E+05          5.84718074900E-05      
  7      6.7529090E+04          1.75599060674E-04      
  8      2.7750837E+04          4.93196602186E-04      
  9      1.1964216E+04          1.31226829573E-03      
 10      5.3707148E+03          3.29846369623E-03      
 11      2.4973194E+03          7.84175005741E-03      
 12      1.1987679E+03          1.72480515091E-02      
 13      5.9258026E+02          3.44467968133E-02      
 14      3.0097708E+02          5.84783371136E-02      
 15      1.5646024E+02          7.46603952199E-02      
 16      8.2476086E+01          3.24181110656E-02      
 17      4.2270887E+01         -1.37178477999E-01      
 18      2.2630220E+01         -3.91475292505E-01      
 19      1.2122374E+01         -3.46221812113E-01      
 20      6.2491700E+00          1.91484676893E-01      
 21      3.2426780E+00          6.49053885060E-01      
 22      1.6663620E+00          4.22831190459E-01      
S   22
  1      1.5443225E+08         -9.04879663264E-09      
  2      2.3129212E+07         -6.86594120612E-08      
  3      5.2617929E+06         -3.53590389667E-07      
  4      1.4888167E+06         -1.46790263725E-06      
  5      4.8465656E+05         -5.29224006834E-06      
  6      1.7427063E+05         -1.71699315789E-05      
  7      6.7529090E+04         -5.15874192905E-05      
  8      2.7750837E+04         -1.44826269526E-04      
  9      1.1964216E+04         -3.85618803517E-04      
 10      5.3707148E+03         -9.68873482845E-04      
 11      2.4973194E+03         -2.30642228051E-03      
 12      1.1987679E+03         -5.07356085636E-03      
 13      5.9258026E+02         -1.01650842496E-02      
 14      3.0097708E+02         -1.72958696619E-02      
 15      1.5646024E+02         -2.22861389659E-02      
 16      8.2476086E+01         -9.67076810160E-03      
 17      4.2270887E+01          4.22566341903E-02      
 18      2.2630220E+01          1.27618464655E-01      
 19      1.2122374E+01          1.16106079395E-01      
 20      6.2491700E+00         -7.57829515687E-02      
 21      3.2426780E+00         -3.01124374295E-01      
 22      1.6663620E+00         -3.62597141808E-01      
S   1
  1      7.8726400E-01          1.0000000        
S   1
  1      4.0297200E-01          1.0000000        
S   1
  1      1.8709600E-01          1.0000000        
S   1
  1      8.4706000E-02          1.0000000        
P   13
  1      3.6511337E+04          4.12479688766E-05      
  2      8.6405510E+03          3.32282000357E-04      
  3      2.8056911E+03          1.82980792974E-03      
  4      1.0734961E+03          7.90289050316E-03      
  5      4.5577475E+02          2.79370789608E-02      
  6      2.0809432E+02          8.11642946879E-02      
  7      1.0023111E+02          1.85848172449E-01      
  8      5.0073522E+01          3.13595667046E-01      
  9      2.5700262E+01          3.40051904252E-01      
 10      1.3346792E+01          1.84973815104E-01      
 11      6.7870510E+00          3.61209039975E-02      
 12      3.3916540E+00          1.69628036309E-03      
 13      1.6703270E+00          2.33086528349E-04      
P   13
  1      3.6511337E+04         -1.64260653152E-05      
  2      8.6405510E+03         -1.32362598118E-04      
  3      2.8056911E+03         -7.31381443393E-04      
  4      1.0734961E+03         -3.17479831947E-03      
  5      4.5577475E+02         -1.13732601418E-02      
  6      2.0809432E+02         -3.38511560633E-02      
  7      1.0023111E+02         -8.06899061019E-02      
  8      5.0073522E+01         -1.43181564062E-01      
  9      2.5700262E+01         -1.59630947074E-01      
 10      1.3346792E+01          2.69359219865E-03      
 11      6.7870510E+00          3.14745196949E-01      
 12      3.3916540E+00          4.75820077460E-01      
 13      1.6703270E+00          2.86403962593E-01      
P   13
  1      3.6511337E+04          3.96554959734E-06      
  2      8.6405510E+03          3.18980644014E-05      
  3      2.8056911E+03          1.76663927402E-04      
  4      1.0734961E+03          7.65863764204E-04      
  5      4.5577475E+02          2.75348607108E-03      
  6      2.0809432E+02          8.20263814840E-03      
  7      1.0023111E+02          1.96979427903E-02      
  8      5.0073522E+01          3.50811664807E-02      
  9      2.5700262E+01          3.95051446783E-02      
 10      1.3346792E+01         -5.41872163189E-03      
 11      6.7870510E+00         -9.33856682838E-02      
 12      3.3916540E+00         -1.53362459415E-01      
 13      1.6703270E+00         -1.01030756748E-01      
P   1
  1      7.5259900E-01          1.0000000        
P   1
  1      3.4681300E-01          1.0000000        
P   1
  1      1.5185500E-01          1.0000000        
P   1
  1      6.3856000E-02          1.0000000        
D   9
  1      1.6350663E+03          6.21662192071E-05      
  2      4.9467266E+02          5.98713349697E-04      
  3      1.9284388E+02          3.56729622197E-03      
  4      8.5782195E+01          1.51296931403E-02      
  5      4.1149966E+01          4.76148294823E-02      
  6      2.0678170E+01          1.16700552642E-01      
  7      1.0726386E+01          2.14540157102E-01      
  8      5.6124540E+00          2.91520392333E-01      
  9      2.9203760E+00          2.99737303719E-01      
D   1
  1      1.4981840E+00          1.0000000        
D   1
  1      7.3599900E-01          1.0000000        
D   1
  1      3.1600400E-01          1.0000000        
D   1
  1      1.3310000E-01          1.0000000        
F   1
  1      8.4420000E-01          1.0000000        
F   1
  1      4.2110000E-01          1.0000000        
F   1
  1      2.1000000E-01          1.0000000        
G   1
  1      8.6590000E-01          1.0000000        
G   1
  1      3.8500000E-01          1.0000000        
H   1
  1      7.2350000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Br
data:
BROMINE
S   22
  1      1.6573515E+08          2.42612846700E-07      
  2      2.4774379E+07          1.84415313566E-06      
  3      5.6282020E+06          9.48804922963E-06      
  4      1.5918997E+06          3.93691908851E-05      
  5      5.1826380E+05          1.41494592802E-04      
  6      1.8649092E+05          4.58192946045E-04      
  7      7.2332493E+04          1.36923173771E-03      
  8      2.9761135E+04          3.82602302610E-03      
  9      1.2851712E+04          1.00588566340E-02      
 10      5.7809430E+03          2.48503991278E-02      
 11      2.6950098E+03          5.69700180249E-02      
 12      1.2976604E+03          1.17934082600E-01      
 13      6.4363493E+02          2.09548208796E-01      
 14      3.2795194E+02          2.92121826865E-01      
 15      1.7092262E+02          2.72104467160E-01      
 16      9.0250141E+01          1.30950065314E-01      
 17      4.6292467E+01          1.99294673116E-02      
 18      2.4848661E+01         -1.63810082151E-05      
 19      1.3347137E+01          4.14204112991E-04      
 20      6.9482580E+00         -2.16630061107E-04      
 21      3.6250750E+00          5.97720700687E-05      
 22      1.8821530E+00         -5.49518251414E-05      
S   22
  1      1.6573515E+08         -7.82936762575E-08      
  2      2.4774379E+07         -5.95047197032E-07      
  3      5.6282020E+06         -3.06243833019E-06      
  4      1.5918997E+06         -1.27046854144E-05      
  5      5.1826380E+05         -4.56940689396E-05      
  6      1.8649092E+05         -1.47987953099E-04      
  7      7.2332493E+04         -4.43133535087E-04      
  8      2.9761135E+04         -1.24110022183E-03      
  9      1.2851712E+04         -3.28670348169E-03      
 10      5.7809430E+03         -8.22037426071E-03      
 11      2.6950098E+03         -1.93798336669E-02      
 12      1.2976604E+03         -4.22120672092E-02      
 13      6.4363493E+02         -8.29708291037E-02      
 14      3.2795194E+02         -1.38043368132E-01      
 15      1.7092262E+02         -1.71243951290E-01      
 16      9.0250141E+01         -7.96738931226E-02      
 17      4.6292467E+01          2.29700803215E-01      
 18      2.4848661E+01          5.14215872796E-01      
 19      1.3347137E+01          3.59437752362E-01      
 20      6.9482580E+00          7.33333181533E-02      
 21      3.6250750E+00          2.97798459300E-03      
 22      1.8821530E+00          1.37349766798E-03      
S   22
  1      1.6573515E+08          3.12198242590E-08      
  2      2.4774379E+07          2.37255369916E-07      
  3      5.6282020E+06          1.22122632567E-06      
  4      1.5918997E+06          5.06546771177E-06      
  5      5.1826380E+05          1.82236555265E-05      
  6      1.8649092E+05          5.90081964289E-05      
  7      7.2332493E+04          1.76787666256E-04      
  8      2.9761135E+04          4.95129972070E-04      
  9      1.2851712E+04          1.31293998400E-03      
 10      5.7809430E+03          3.28773248073E-03      
 11      2.6950098E+03          7.78341970583E-03      
 12      1.2976604E+03          1.70587151409E-02      
 13      6.4363493E+02          3.40158216525E-02      
 14      3.2795194E+02          5.79749203601E-02      
 15      1.7092262E+02          7.52597400707E-02      
 16      9.0250141E+01          3.65948120540E-02      
 17      4.6292467E+01         -1.28763649907E-01      
 18      2.4848661E+01         -3.86805293768E-01      
 19      1.3347137E+01         -3.63652300004E-01      
 20      6.9482580E+00          1.60527111381E-01      
 21      3.6250750E+00          6.47923813502E-01      
 22      1.8821530E+00          4.43681175382E-01      
S   22
  1      1.6573515E+08         -9.59729954845E-09      
  2      2.4774379E+07         -7.29258751702E-08      
  3      5.6282020E+06         -3.75440325538E-07      
  4      1.5918997E+06         -1.55689770203E-06      
  5      5.1826380E+05         -5.60289796383E-06      
  6      1.8649092E+05         -1.81355405661E-05      
  7      7.2332493E+04         -5.43599702726E-05      
  8      2.9761135E+04         -1.52174418131E-04      
  9      1.2851712E+04         -4.03823430659E-04      
 10      5.7809430E+03         -1.01075966181E-03      
 11      2.6950098E+03         -2.39618361825E-03      
 12      1.2976604E+03         -5.25196632043E-03      
 13      6.4363493E+02         -1.05073805629E-02      
 14      3.2795194E+02         -1.79476136245E-02      
 15      1.7092262E+02         -2.35193435512E-02      
 16      9.0250141E+01         -1.14369085155E-02      
 17      4.6292467E+01          4.15219803857E-02      
 18      2.4848661E+01          1.32147831665E-01      
 19      1.3347137E+01          1.28155584011E-01      
 20      6.9482580E+00         -6.66612929955E-02      
 21      3.6250750E+00         -3.16077632338E-01      
 22      1.8821530E+00         -3.93784145700E-01      
S   1
  1      9.1082200E-01          1.0000000        
S   1
  1      4.6395700E-01          1.0000000        
S   1
  1      2.1693300E-01          1.0000000        
S   1
  1      9.8406000E-02          1.0000000        
P   13
  1      3.9391530E+04          4.08571750199E-05      
  2      9.3252225E+03          3.27012953687E-04      
  3      3.0289943E+03          1.79460020595E-03      
  4      1.1595145E+03          7.73599407806E-03      
  5      4.9268131E+02          2.73297634657E-02      
  6      2.2517451E+02          7.94849293247E-02      
  7      1.0859326E+02          1.82701190866E-01      
  8      5.4336079E+01          3.10496884142E-01      
  9      2.7936650E+01          3.40916280322E-01      
 10      1.4539626E+01          1.89565765960E-01      
 11      7.4213070E+00          3.83829290312E-02      
 12      3.7303890E+00          1.78890298979E-03      
 13      1.8541270E+00          2.16361179349E-04      
P   13
  1      3.9391530E+04         -1.64963642862E-05      
  2      9.3252225E+03         -1.32089855929E-04      
  3      3.0289943E+03         -7.27280848399E-04      
  4      1.1595145E+03         -3.15126290380E-03      
  5      4.9268131E+02         -1.12795861979E-02      
  6      2.2517451E+02         -3.36068362575E-02      
  7      1.0859326E+02         -8.04016928607E-02      
  8      5.4336079E+01         -1.43739761833E-01      
  9      2.7936650E+01         -1.62488930191E-01      
 10      1.4539626E+01         -3.11882730470E-03      
 11      7.4213070E+00          3.11181995165E-01      
 12      3.7303890E+00          4.79464319180E-01      
 13      1.8541270E+00          2.87403971372E-01      
P   13
  1      3.9391530E+04          4.26694013131E-06      
  2      9.3252225E+03          3.40867174696E-05      
  3      3.0289943E+03          1.88231497836E-04      
  4      1.1595145E+03          8.14048130078E-04      
  5      4.9268131E+02          2.92636047228E-03      
  6      2.2517451E+02          8.72170489384E-03      
  7      1.0859326E+02          2.10428357162E-02      
  8      5.4336079E+01          3.77310007988E-02      
  9      2.7936650E+01          4.31865394506E-02      
 10      1.4539626E+01         -4.49133771577E-03      
 11      7.4213070E+00         -9.96237338515E-02      
 12      3.7303890E+00         -1.68927638469E-01      
 13      1.8541270E+00         -1.06649131571E-01      
P   1
  1      8.4533700E-01          1.0000000        
P   1
  1      3.9215200E-01          1.0000000        
P   1
  1      1.7276700E-01          1.0000000        
P   1
  1      7.2908000E-02          1.0000000        
D   9
  1      1.8506354E+03          5.69070675989E-05      
  2      5.5707125E+02          5.55692834162E-04      
  3      2.1648687E+02          3.34766506942E-03      
  4      9.6138850E+01          1.43924663958E-02      
  5      4.6126380E+01          4.59258067655E-02      
  6      2.3201164E+01          1.14097449085E-01      
  7      1.2055926E+01          2.13168819494E-01      
  8      6.3255450E+00          2.93851364334E-01      
  9      3.3049220E+00          3.03675908600E-01      
D   1
  1      1.7042530E+00          1.0000000        
D   1
  1      8.3994000E-01          1.0000000        
D   1
  1      3.5695300E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      9.6270000E-01          1.0000000        
F   1
  1      4.9550000E-01          1.0000000        
F   1
  1      2.5500000E-01          1.0000000        
G   1
  1      9.7680000E-01          1.0000000        
G   1
  1      4.3900000E-01          1.0000000        
H   1
  1      8.1930000E-01          1.0000000        


name: cc-pV5Z(pt/sf/sc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   22
  1      1.8282209E+08          2.33669182657E-07      
  2      2.7356156E+07          1.77039832794E-06      
  3      6.2211704E+06          9.08724004414E-06      
  4      1.7602779E+06          3.76483847823E-05      
  5      5.7319382E+05          1.35162717959E-04      
  6      2.0625845E+05          4.37200643059E-04      
  7      8.0026669E+04          1.30435546045E-03      
  8      3.2939084E+04          3.64175001477E-03      
  9      1.4222633E+04          9.57935541658E-03      
 10      6.3930707E+03          2.37150747961E-02      
 11      2.9764538E+03          5.45921060985E-02      
 12      1.4305254E+03          1.13801968129E-01      
 13      7.0792621E+02          2.04422529374E-01      
 14      3.5984847E+02          2.89737950698E-01      
 15      1.8714965E+02          2.76995653785E-01      
 16      9.8634523E+01          1.38844358504E-01      
 17      5.0547869E+01          2.24725021577E-02      
 18      2.7167004E+01         -8.18174113261E-05      
 19      1.4615098E+01          5.04977402306E-04      
 20      7.6513520E+00         -2.63695026947E-04      
 21      3.9972630E+00          8.48275035294E-05      
 22      2.0858530E+00         -7.03546253399E-05      
S   22
  1      1.8282209E+08         -7.57385542863E-08      
  2      2.7356156E+07         -5.73757066289E-07      
  3      6.2211704E+06         -2.94595524140E-06      
  4      1.7602779E+06         -1.22027141237E-05      
  5      5.7319382E+05         -4.38409207896E-05      
  6      2.0625845E+05         -1.41825297502E-04      
  7      8.0026669E+04         -4.23968939142E-04      
  8      3.2939084E+04         -1.18632021802E-03      
  9      1.4222633E+04         -3.14253888982E-03      
 10      6.3930707E+03         -7.87214675072E-03      
 11      2.9764538E+03         -1.86169157892E-02      
 12      1.4305254E+03         -4.07585063657E-02      
 13      7.0792621E+02         -8.07224346437E-02      
 14      3.5984847E+02         -1.35825421113E-01      
 15      1.8714965E+02         -1.72033734527E-01      
 16      9.8634523E+01         -8.81440996017E-02      
 17      5.0547869E+01          2.14333803446E-01      
 18      2.7167004E+01          5.09853865334E-01      
 19      1.4615098E+01          3.72431382754E-01      
 20      7.6513520E+00          8.08691542279E-02      
 21      3.9972630E+00          3.54301940893E-03      
 22      2.0858530E+00          1.38640360970E-03      
S   22
  1      1.8282209E+08          3.04895754357E-08      
  2      2.7356156E+07          2.30957545285E-07      
  3      6.2211704E+06          1.18599147175E-06      
  4      1.7602779E+06          4.91197405568E-06      
  5      5.7319382E+05          1.76513261757E-05      
  6      2.0625845E+05          5.70936929891E-05      
  7      8.0026669E+04          1.70752212309E-04      
  8      3.2939084E+04          4.77818018372E-04      
  9      1.4222633E+04          1.26724112716E-03      
 10      6.3930707E+03          3.17849774678E-03      
 11      2.9764538E+03          7.54653379126E-03      
 12      1.4305254E+03          1.66242247421E-02      
 13      7.0792621E+02          3.33827339847E-02      
 14      3.5984847E+02          5.75248323206E-02      
 15      1.8714965E+02          7.61583962438E-02      
 16      9.8634523E+01          4.09172775162E-02      
 17      5.0547869E+01         -1.21016881060E-01      
 18      2.7167004E+01         -3.82795958146E-01      
 19      1.4615098E+01         -3.79298526263E-01      
 20      7.6513520E+00          1.36744442040E-01      
 21      3.9972630E+00          6.52074402241E-01      
 22      2.0858530E+00          4.56985639969E-01      
S   22
  1      1.8282209E+08         -9.73521456706E-09      
  2      2.7356156E+07         -7.37318357615E-08      
  3      6.2211704E+06         -3.78713473857E-07      
  4      1.7602779E+06         -1.56799464072E-06      
  5      5.7319382E+05         -5.63701437790E-06      
  6      2.0625845E+05         -1.82239961969E-05      
  7      8.0026669E+04         -5.45380843787E-05      
  8      3.2939084E+04         -1.52514227749E-04      
  9      1.4222633E+04         -4.04878343026E-04      
 10      6.3930707E+03         -1.01481040743E-03      
 11      2.9764538E+03         -2.41340857664E-03      
 12      1.4305254E+03         -5.31504220228E-03      
 13      7.0792621E+02         -1.07127720281E-02      
 14      3.5984847E+02         -1.84910637125E-02      
 15      1.8714965E+02         -2.47348858635E-02      
 16      9.8634523E+01         -1.32687988206E-02      
 17      5.0547869E+01          4.04809401229E-02      
 18      2.7167004E+01          1.36114758945E-01      
 19      1.4615098E+01          1.39072462768E-01      
 20      7.6513520E+00         -5.85545382766E-02      
 21      3.9972630E+00         -3.34441441048E-01      
 22      2.0858530E+00         -4.20213965130E-01      
S   1
  1      1.0147970E+00          1.0000000        
S   1
  1      5.1978800E-01          1.0000000        
S   1
  1      2.4510300E-01          1.0000000        
S   1
  1      1.1189600E-01          1.0000000        
P   13
  1      4.2993056E+04          3.96246922643E-05      
  2      1.0173723E+04          3.15350430164E-04      
  3      3.3031057E+03          1.72738741109E-03      
  4      1.2635400E+03          7.45505255759E-03      
  5      5.3636546E+02          2.64333294277E-02      
  6      2.4487617E+02          7.73210812053E-02      
  7      1.1799117E+02          1.79157210493E-01      
  8      5.9021248E+01          3.07519079445E-01      
  9      3.0356067E+01          3.42360888473E-01      
 10      1.5819977E+01          1.94570955075E-01      
 11      8.1045800E+00          4.08241845689E-02      
 12      4.0979640E+00          1.91431677419E-03      
 13      2.0560610E+00          1.95393899046E-04      
P   13
  1      4.2993056E+04         -1.62157623667E-05      
  2      1.0173723E+04         -1.29123733102E-04      
  3      3.3031057E+03         -7.09522751462E-04      
  4      1.2635400E+03         -3.07811444837E-03      
  5      5.3636546E+02         -1.10545473506E-02      
  6      2.4487617E+02         -3.31216867741E-02      
  7      1.1799117E+02         -7.98599918370E-02      
  8      5.9021248E+01         -1.44253919694E-01      
  9      3.0356067E+01         -1.65643300939E-01      
 10      1.5819977E+01         -9.48678437651E-03      
 11      8.1045800E+00          3.06954909895E-01      
 12      4.0979640E+00          4.82742935273E-01      
 13      2.0560610E+00          2.89366308903E-01      
P   13
  1      4.2993056E+04          4.40632406374E-06      
  2      1.0173723E+04          3.49952502635E-05      
  3      3.3031057E+03          1.92924502240E-04      
  4      1.2635400E+03          8.35126781474E-04      
  5      5.3636546E+02          3.01330362346E-03      
  6      2.4487617E+02          9.02941837556E-03      
  7      1.1799117E+02          2.19688808581E-02      
  8      5.9021248E+01          3.97963950247E-02      
  9      3.0356067E+01          4.63379242672E-02      
 10      1.5819977E+01         -3.09917819991E-03      
 11      8.1045800E+00         -1.04157541518E-01      
 12      4.0979640E+00         -1.81937587630E-01      
 13      2.0560610E+00         -1.11506561023E-01      
P   1
  1      9.5214500E-01          1.0000000        
P   1
  1      4.4477400E-01          1.0000000        
P   1
  1      1.9749600E-01          1.0000000        
P   1
  1      8.3823000E-02          1.0000000        
D   9
  1      2.0674360E+03          5.27679614464E-05      
  2      6.2569371E+02          5.10364487637E-04      
  3      2.4394679E+02          3.07669283226E-03      
  4      1.0842373E+02          1.34040693701E-02      
  5      5.2005216E+01          4.36414229193E-02      
  6      2.6115405E+01          1.10803211209E-01      
  7      1.3546748E+01          2.11675707237E-01      
  8      7.1058100E+00          2.96399740781E-01      
  9      3.7215540E+00          3.07475165532E-01      
D   1
  1      1.9291200E+00          1.0000000        
D   1
  1      9.5582600E-01          1.0000000        
D   1
  1      4.0519700E-01          1.0000000        
D   1
  1      1.7410000E-01          1.0000000        
F   1
  1      1.0940000E+00          1.0000000        
F   1
  1      5.8700000E-01          1.0000000        
F   1
  1      3.1500000E-01          1.0000000        
G   1
  1      1.1040000E+00          1.0000000        
G   1
  1      5.0100000E-01          1.0000000        
H   1
  1      9.3030000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: H
data:
HYDROGEN
S   4
  1      4.0200000E+02          2.79717006163E-04      
  2      6.0240000E+01          2.16631837016E-03      
  3      1.3730000E+01          1.12037817793E-02      
  4      3.9050000E+00          4.48824002848E-02      
S   1
  1      1.2830000E+00          1.0000000        
S   1
  1      4.6550000E-01          1.0000000        
S   1
  1      1.8110000E-01          1.0000000        
S   1
  1      7.2790000E-02          1.0000000        
P   1
  1      4.5160000E+00          1.0000000        
P   1
  1      1.7120000E+00          1.0000000        
P   1
  1      6.4900000E-01          1.0000000        
P   1
  1      2.4600000E-01          1.0000000        
D   1
  1      2.9500000E+00          1.0000000        
D   1
  1      1.2060000E+00          1.0000000        
D   1
  1      4.9300000E-01          1.0000000        
F   1
  1      8.7500000E-01          1.0000000        
F   1
  1      2.5060000E+00          1.0000000        
G   1
  1      2.3580000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1      1.1450000E+03          3.59819205698E-04      
  2      1.7170000E+02          2.77464401056E-03      
  3      3.9070000E+01          1.42597792662E-02      
  4      1.1040000E+01          5.55816766045E-02      
S   1
  1      3.5660000E+00          1.0000000        
S   1
  1      1.2400000E+00          1.0000000        
S   1
  1      4.4730000E-01          1.0000000        
S   1
  1      1.6400000E-01          1.0000000        
P   1
  1      1.0153000E+01          1.0000000        
P   1
  1      3.6270000E+00          1.0000000        
P   1
  1      1.2960000E+00          1.0000000        
P   1
  1      4.6300000E-01          1.0000000        
D   1
  1      7.6660000E+00          1.0000000        
D   1
  1      2.6470000E+00          1.0000000        
D   1
  1      9.1400000E-01          1.0000000        
F   1
  1      5.4110000E+00          1.0000000        
F   1
  1      1.7070000E+00          1.0000000        
G   1
  1      3.4300000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: B
data:
BORON
S   10
  1      6.8260000E+04          2.53942262631E-05      
  2      1.0230000E+04          1.89451626399E-04      
  3      2.3280000E+03          9.82334402693E-04      
  4      6.6040000E+02          4.08392437977E-03      
  5      2.1620000E+02          1.44551079264E-02      
  6      7.8600000E+01          4.39950680417E-02      
  7      3.0980000E+01          1.13172438975E-01      
  8      1.2960000E+01          2.33891038397E-01      
  9      5.6590000E+00          3.53871511712E-01      
 10      2.5560000E+00          3.01330281801E-01      
S   10
  1      6.8260000E+04         -5.12554364208E-06      
  2      1.0230000E+04         -3.83536984908E-05      
  3      2.3280000E+03         -1.98173754299E-04      
  4      6.6040000E+02         -8.30323978315E-04      
  5      2.1620000E+02         -2.93603894589E-03      
  6      7.8600000E+01         -9.16317183663E-03      
  7      3.0980000E+01         -2.41437747450E-02      
  8      1.2960000E+01         -5.48021062081E-02      
  9      5.6590000E+00         -9.69609670001E-02      
 10      2.5560000E+00         -1.37447817189E-01      
S   1
  1      1.1750000E+00          1.0000000        
S   1
  1      4.2490000E-01          1.0000000        
S   1
  1      1.7120000E-01          1.0000000        
S   1
  1      6.9130000E-02          1.0000000        
P   4
  1      6.6440000E+01          8.43814188814E-04      
  2      1.5710000E+01          6.41745070047E-03      
  3      4.9360000E+00          2.80895461966E-02      
  4      1.7700000E+00          9.21475099294E-02      
P   1
  1      7.0080000E-01          1.0000000        
P   1
  1      2.9010000E-01          1.0000000        
P   1
  1      1.2110000E-01          1.0000000        
P   1
  1      4.9730000E-02          1.0000000        
D   1
  1      2.0100000E+00          1.0000000        
D   1
  1      7.9600000E-01          1.0000000        
D   1
  1      3.1600000E-01          1.0000000        
D   1
  1      1.2500000E-01          1.0000000        
F   1
  1      1.2150000E+00          1.0000000        
F   1
  1      5.2500000E-01          1.0000000        
F   1
  1      2.2700000E-01          1.0000000        
G   1
  1      1.1240000E+00          1.0000000        
G   1
  1      4.6100000E-01          1.0000000        
H   1
  1      8.3400000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: C
data:
CARBON
S   10
  1      9.6770000E+04          2.68886256911E-05      
  2      1.4500000E+04          1.97333076426E-04      
  3      3.3000000E+03          1.01795162008E-03      
  4      9.3580000E+02          4.22508218867E-03      
  5      3.0620000E+02          1.49436259794E-02      
  6      1.1130000E+02          4.54430774214E-02      
  7      4.3900000E+01          1.16679634501E-01      
  8      1.8400000E+01          2.40353760856E-01      
  9      8.0540000E+00          3.58683502146E-01      
 10      3.6370000E+00          2.93648793514E-01      
S   10
  1      9.6770000E+04         -5.74442446194E-06      
  2      1.4500000E+04         -4.22634480367E-05      
  3      3.3000000E+03         -2.17430137933E-04      
  4      9.3580000E+02         -9.08762844167E-04      
  5      3.0620000E+02         -3.21666507656E-03      
  6      1.1130000E+02         -1.00267953123E-02      
  7      4.3900000E+01         -2.65074190644E-02      
  8      1.8400000E+01         -6.02323130684E-02      
  9      8.0540000E+00         -1.07171943956E-01      
 10      3.6370000E+00         -1.44537922176E-01      
S   1
  1      1.6560000E+00          1.0000000        
S   1
  1      6.3330000E-01          1.0000000        
S   1
  1      2.5450000E-01          1.0000000        
S   1
  1      1.0190000E-01          1.0000000        
P   4
  1      1.0180000E+02          8.92923810884E-04      
  2      2.4040000E+01          6.93856199571E-03      
  3      7.5710000E+00          3.14711412529E-02      
  4      2.7320000E+00          1.03518247739E-01      
P   1
  1      1.0850000E+00          1.0000000        
P   1
  1      4.4960000E-01          1.0000000        
P   1
  1      1.8760000E-01          1.0000000        
P   1
  1      7.6060000E-02          1.0000000        
D   1
  1      3.1340000E+00          1.0000000        
D   1
  1      1.2330000E+00          1.0000000        
D   1
  1      4.8500000E-01          1.0000000        
D   1
  1      1.9100000E-01          1.0000000        
F   1
  1      2.0060000E+00          1.0000000        
F   1
  1      8.3800000E-01          1.0000000        
F   1
  1      3.5000000E-01          1.0000000        
G   1
  1      1.7530000E+00          1.0000000        
G   1
  1      6.7800000E-01          1.0000000        
H   1
  1      1.2590000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: N
data:
NITROGEN
S   10
  1      1.2920000E+05          2.86184968460E-05      
  2      1.9350000E+04          2.06211150989E-04      
  3      4.4040000E+03          1.05795982142E-03      
  4      1.2480000E+03          4.38311770132E-03      
  5      4.0800000E+02          1.54990160666E-02      
  6      1.4820000E+02          4.70671901648E-02      
  7      5.8500000E+01          1.20363922971E-01      
  8      2.4590000E+01          2.45842715206E-01      
  9      1.0810000E+01          3.61227683342E-01      
 10      4.8820000E+00          2.86888180168E-01      
S   10
  1      1.2920000E+05         -6.34284519270E-06      
  2      1.9350000E+04         -4.57960441316E-05      
  3      4.4040000E+03         -2.34506354244E-04      
  4      1.2480000E+03         -9.77522685304E-04      
  5      4.0800000E+02         -3.46507869123E-03      
  6      1.4820000E+02         -1.07808417040E-02      
  7      5.8500000E+01         -2.85205915572E-02      
  8      2.4590000E+01         -6.44615994496E-02      
  9      1.0810000E+01         -1.14649025003E-01      
 10      4.8820000E+00         -1.47767083007E-01      
S   1
  1      2.1950000E+00          1.0000000        
S   1
  1      8.7150000E-01          1.0000000        
S   1
  1      3.5040000E-01          1.0000000        
S   1
  1      1.3970000E-01          1.0000000        
P   4
  1      1.4700000E+02          8.94929114583E-04      
  2      3.4760000E+01          7.03387485928E-03      
  3      1.1000000E+01          3.25594098438E-02      
  4      3.9950000E+00          1.07630151898E-01      
P   1
  1      1.5870000E+00          1.0000000        
P   1
  1      6.5330000E-01          1.0000000        
P   1
  1      2.6860000E-01          1.0000000        
P   1
  1      1.0670000E-01          1.0000000        
D   1
  1      4.6470000E+00          1.0000000        
D   1
  1      1.8130000E+00          1.0000000        
D   1
  1      7.0700000E-01          1.0000000        
D   1
  1      2.7600000E-01          1.0000000        
F   1
  1      2.9420000E+00          1.0000000        
F   1
  1      1.2040000E+00          1.0000000        
F   1
  1      4.9300000E-01          1.0000000        
G   1
  1      2.5110000E+00          1.0000000        
G   1
  1      9.4200000E-01          1.0000000        
H   1
  1      1.7680000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: O
data:
OXYGEN
S   10
  1      1.6420000E+05          3.07746115622E-05      
  2      2.4590000E+04          2.17544600216E-04      
  3      5.5920000E+03          1.11037458485E-03      
  4      1.5820000E+03          4.60007909373E-03      
  5      5.1610000E+02          1.62666659105E-02      
  6      1.8720000E+02          4.93498059901E-02      
  7      7.3930000E+01          1.25175231081E-01      
  8      3.1220000E+01          2.51843374826E-01      
  9      1.3810000E+01          3.62126192944E-01      
 10      6.2560000E+00          2.78471991235E-01      
S   10
  1      1.6420000E+05         -7.00045844533E-06      
  2      2.4590000E+04         -4.95676223753E-05      
  3      5.5920000E+03         -2.52681624556E-04      
  4      1.5820000E+03         -1.05255067065E-03      
  5      5.1610000E+02         -3.73669148025E-03      
  6      1.8720000E+02         -1.16128373886E-02      
  7      7.3930000E+01         -3.06080308922E-02      
  8      3.1220000E+01         -6.83875360950E-02      
  9      1.3810000E+01         -1.20608208639E-01      
 10      6.2560000E+00         -1.48206838754E-01      
S   1
  1      2.7760000E+00          1.0000000        
S   1
  1      1.1380000E+00          1.0000000        
S   1
  1      4.6000000E-01          1.0000000        
S   1
  1      1.8290000E-01          1.0000000        
P   4
  1      1.9550000E+02          9.34401143505E-04      
  2      4.6160000E+01          7.41113908488E-03      
  3      1.4580000E+01          3.49708595625E-02      
  4      5.2960000E+00          1.15370241576E-01      
P   1
  1      2.0940000E+00          1.0000000        
P   1
  1      8.4710000E-01          1.0000000        
P   1
  1      3.3680000E-01          1.0000000        
P   1
  1      1.2850000E-01          1.0000000        
D   1
  1      5.8790000E+00          1.0000000        
D   1
  1      2.3070000E+00          1.0000000        
D   1
  1      9.0500000E-01          1.0000000        
D   1
  1      3.5500000E-01          1.0000000        
F   1
  1      4.0160000E+00          1.0000000        
F   1
  1      1.5540000E+00          1.0000000        
F   1
  1      6.0100000E-01          1.0000000        
G   1
  1      3.3500000E+00          1.0000000        
G   1
  1      1.1890000E+00          1.0000000        
H   1
  1      2.3190000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: F
data:
FLUORINE
S   10
  1      2.1140000E+05          3.14673639807E-05      
  2      3.1660000E+04          2.17381370527E-04      
  3      7.2020000E+03          1.09952907241E-03      
  4      2.0400000E+03          4.53053655823E-03      
  5      6.6640000E+02          1.59651070766E-02      
  6      2.4200000E+02          4.84446778827E-02      
  7      9.5530000E+01          1.23637295566E-01      
  8      4.0230000E+01          2.51720615570E-01      
  9      1.7720000E+01          3.64128229387E-01      
 10      8.0050000E+00          2.79011397228E-01      
S   10
  1      2.1140000E+05         -7.29831275678E-06      
  2      3.1660000E+04         -5.04994252627E-05      
  3      7.2020000E+03         -2.55134225197E-04      
  4      2.0400000E+03         -1.05692913458E-03      
  5      6.6640000E+02         -3.73967742662E-03      
  6      2.4200000E+02         -1.16226918986E-02      
  7      9.5530000E+01         -3.08404473970E-02      
  8      4.0230000E+01         -6.97835262180E-02      
  9      1.7720000E+01         -1.24086206197E-01      
 10      8.0050000E+00         -1.49841638458E-01      
S   1
  1      3.5380000E+00          1.0000000        
S   1
  1      1.4580000E+00          1.0000000        
S   1
  1      5.8870000E-01          1.0000000        
S   1
  1      2.3240000E-01          1.0000000        
P   4
  1      2.4190000E+02          1.02650897573E-03      
  2      5.7170000E+01          8.10698986043E-03      
  3      1.8130000E+01          3.81452204999E-02      
  4      6.6240000E+00          1.23870700662E-01      
P   1
  1      2.6220000E+00          1.0000000        
P   1
  1      1.0570000E+00          1.0000000        
P   1
  1      4.1760000E-01          1.0000000        
P   1
  1      1.5740000E-01          1.0000000        
D   1
  1      7.7600000E+00          1.0000000        
D   1
  1      3.0320000E+00          1.0000000        
D   1
  1      1.1850000E+00          1.0000000        
D   1
  1      4.6300000E-01          1.0000000        
F   1
  1      5.3980000E+00          1.0000000        
F   1
  1      2.0780000E+00          1.0000000        
F   1
  1      8.0000000E-01          1.0000000        
G   1
  1      4.3380000E+00          1.0000000        
G   1
  1      1.5130000E+00          1.0000000        
H   1
  1      2.9950000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ne
data:
NEON
S   10
  1      2.6270000E+05          3.26640538483E-05      
  2      3.9350000E+04          2.20066213552E-04      
  3      8.9550000E+03          1.10373807033E-03      
  4      2.5380000E+03          4.52083019125E-03      
  5      8.2990000E+02          1.58945936709E-02      
  6      3.0150000E+02          4.81700764566E-02      
  7      1.1900000E+02          1.23448687667E-01      
  8      5.0000000E+01          2.52736621328E-01      
  9      2.1980000E+01          3.65811585506E-01      
 10      9.8910000E+00          2.78675545402E-01      
S   10
  1      2.6270000E+05         -7.69247833526E-06      
  2      3.9350000E+04         -5.18984177358E-05      
  3      8.9550000E+03         -2.60106252290E-04      
  4      2.5380000E+03         -1.07057522908E-03      
  5      8.2990000E+02         -3.78215463341E-03      
  6      3.0150000E+02         -1.17313010387E-02      
  7      1.1900000E+02         -3.13126169859E-02      
  8      5.0000000E+01         -7.12440195086E-02      
  9      2.1980000E+01         -1.27387257534E-01      
 10      9.8910000E+00         -1.50724156067E-01      
S   1
  1      4.3270000E+00          1.0000000        
S   1
  1      1.8040000E+00          1.0000000        
S   1
  1      7.2880000E-01          1.0000000        
S   1
  1      2.8670000E-01          1.0000000        
P   4
  1      2.9910000E+02          1.07025607118E-03      
  2      7.0730000E+01          8.44508684464E-03      
  3      2.2480000E+01          3.98253341192E-02      
  4      8.2460000E+00          1.28182299235E-01      
P   1
  1      3.2690000E+00          1.0000000        
P   1
  1      1.3150000E+00          1.0000000        
P   1
  1      5.1580000E-01          1.0000000        
P   1
  1      1.9180000E-01          1.0000000        
D   1
  1      9.8370000E+00          1.0000000        
D   1
  1      3.8440000E+00          1.0000000        
D   1
  1      1.5020000E+00          1.0000000        
D   1
  1      5.8700000E-01          1.0000000        
F   1
  1      7.0900000E+00          1.0000000        
F   1
  1      2.7380000E+00          1.0000000        
F   1
  1      1.0570000E+00          1.0000000        
G   1
  1      5.4600000E+00          1.0000000        
G   1
  1      1.8800000E+00          1.0000000        
H   1
  1      3.7760000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   16
  1      3.2690000E+06          4.76392372798E-06      
  2      4.8940000E+05          2.40728869955E-05      
  3      1.1140000E+05          1.07130037574E-04      
  4      3.1560000E+04          4.13738364279E-04      
  5      1.0320000E+04          1.43499636861E-03      
  6      3.7310000E+03          4.54698655853E-03      
  7      1.4560000E+03          1.32462118025E-02      
  8      6.0410000E+02          3.53922421783E-02      
  9      2.6350000E+02          8.51146433473E-02      
 10      1.1980000E+02          1.76551898190E-01      
 11      5.6320000E+01          2.91961707580E-01      
 12      2.7190000E+01          3.26949395808E-01      
 13      1.3260000E+01          1.85670892922E-01      
 14      6.0520000E+00          3.07574707244E-02      
 15      2.9810000E+00         -4.99311071820E-04      
 16      1.4760000E+00          1.47351611120E-03      
S   16
  1      3.2690000E+06         -1.24379465334E-06      
  2      4.8940000E+05         -6.29102381054E-06      
  3      1.1140000E+05         -2.79903598993E-05      
  4      3.1560000E+04         -1.08254974489E-04      
  5      1.0320000E+04         -3.75468387279E-04      
  6      3.7310000E+03         -1.19496908326E-03      
  7      1.4560000E+03         -3.49932912909E-03      
  8      6.0410000E+02         -9.52156244067E-03      
  9      2.6350000E+02         -2.36382971649E-02      
 10      1.1980000E+02         -5.28067552040E-02      
 11      5.6320000E+01         -1.00326842759E-01      
 12      2.7190000E+01         -1.50404155389E-01      
 13      1.3260000E+01         -1.17517778802E-01      
 14      6.0520000E+00          1.10616167306E-01      
 15      2.9810000E+00          4.12191265738E-01      
 16      1.4760000E+00          4.55687574102E-01      
S   16
  1      3.2690000E+06          2.87289166372E-07      
  2      4.8940000E+05          1.45213553199E-06      
  3      1.1140000E+05          6.46885461565E-06      
  4      3.1560000E+04          2.49767955598E-05      
  5      1.0320000E+04          8.68339351516E-05      
  6      3.7310000E+03          2.75630743206E-04      
  7      1.4560000E+03          8.10395838259E-04      
  8      6.0410000E+02          2.19849317198E-03      
  9      2.6350000E+02          5.50004451931E-03      
 10      1.1980000E+02          1.22762450968E-02      
 11      5.6320000E+01          2.37834479649E-02      
 12      2.7190000E+01          3.60484761013E-02      
 13      1.3260000E+01          2.99468640920E-02      
 14      6.0520000E+00         -3.17213015141E-02      
 15      2.9810000E+00         -1.19488808987E-01      
 16      1.4760000E+00         -2.11596247748E-01      
S   1
  1      7.3340000E-01          1.0000000        
S   1
  1      2.4470000E-01          1.0000000        
S   1
  1      1.0880000E-01          1.0000000        
S   1
  1      4.6720000E-02          1.0000000        
P   8
  1      1.4610000E+03          2.35640842635E-04      
  2      3.4620000E+02          1.87178368840E-03      
  3      1.1220000E+02          9.88447084796E-03      
  4      4.2510000E+01          3.80782930663E-02      
  5      1.7720000E+01          1.11216676567E-01      
  6      7.8520000E+00          2.34424657682E-01      
  7      3.5710000E+00          3.45087776854E-01      
  8      1.6370000E+00          3.31072904406E-01      
P   8
  1      1.4610000E+03         -4.20237560627E-05      
  2      3.4620000E+02         -3.39452160723E-04      
  3      1.1220000E+02         -1.76851446567E-03      
  4      4.2510000E+01         -6.98906133381E-03      
  5      1.7720000E+01         -2.03228922006E-02      
  6      7.8520000E+00         -4.48445960998E-02      
  7      3.5710000E+00         -6.42280864652E-02      
  8      1.6370000E+00         -7.51099113343E-02      
P   1
  1      7.3820000E-01          1.0000000        
P   1
  1      2.5770000E-01          1.0000000        
P   1
  1      9.7730000E-02          1.0000000        
P   1
  1      3.6900000E-02          1.0000000        
D   1
  1      1.3170000E+00          1.0000000        
D   1
  1      5.2600000E-01          1.0000000        
D   1
  1      2.1000000E-01          1.0000000        
D   1
  1      8.4000000E-02          1.0000000        
F   1
  1      5.1300000E-01          1.0000000        
F   1
  1      2.5800000E-01          1.0000000        
F   1
  1      1.3000000E-01          1.0000000        
G   1
  1      5.4300000E-01          1.0000000        
G   1
  1      2.5200000E-01          1.0000000        
H   1
  1      4.4600000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Si
data:
SILICON
S   16
  1      3.9480000E+06          5.00618840783E-06      
  2      5.9110000E+05          2.42582973745E-05      
  3      1.3450000E+05          1.05516056023E-04      
  4      3.8120000E+04          4.01864486819E-04      
  5      1.2460000E+04          1.38501141594E-03      
  6      4.5040000E+03          4.36722540347E-03      
  7      1.7580000E+03          1.27002401688E-02      
  8      7.2910000E+02          3.39623693665E-02      
  9      3.1800000E+02          8.18640325889E-02      
 10      1.4460000E+02          1.71063170057E-01      
 11      6.7970000E+01          2.86791783820E-01      
 12      3.2820000E+01          3.28909865485E-01      
 13      1.6030000E+01          1.95093133901E-01      
 14      7.3960000E+00          3.50782853784E-02      
 15      3.6610000E+00         -5.24778883605E-04      
 16      1.8230000E+00          1.59573331923E-03      
S   16
  1      3.9480000E+06         -1.33927873198E-06      
  2      5.9110000E+05         -6.49602164437E-06      
  3      1.3450000E+05         -2.82551134738E-05      
  4      3.8120000E+04         -1.07752427648E-04      
  5      1.2460000E+04         -3.71447732965E-04      
  6      4.5040000E+03         -1.17602456452E-03      
  7      1.7580000E+03         -3.43832440206E-03      
  8      7.2910000E+02         -9.35600464634E-03      
  9      3.1800000E+02         -2.32727699049E-02      
 10      1.4460000E+02         -5.22562386710E-02      
 11      6.7970000E+01         -1.00377980072E-01      
 12      3.2820000E+01         -1.52602078825E-01      
 13      1.6030000E+01         -1.25666120981E-01      
 14      7.3960000E+00          9.77289415435E-02      
 15      3.6610000E+00          4.15434959781E-01      
 16      1.8230000E+00          4.66048288139E-01      
S   16
  1      3.9480000E+06          3.43832992812E-07      
  2      5.9110000E+05          1.66679960071E-06      
  3      1.3450000E+05          7.25789188259E-06      
  4      3.8120000E+04          2.76370236178E-05      
  5      1.2460000E+04          9.54762447581E-05      
  6      4.5040000E+03          3.01572271079E-04      
  7      1.7580000E+03          8.84987328470E-04      
  8      7.2910000E+02          2.40204251289E-03      
  9      3.1800000E+02          6.01913738457E-03      
 10      1.4460000E+02          1.35158328390E-02      
 11      6.7970000E+01          2.64690462015E-02      
 12      3.2820000E+01          4.07872596375E-02      
 13      1.6030000E+01          3.56887063600E-02      
 14      7.3960000E+00         -3.14611540120E-02      
 15      3.6610000E+00         -1.36998431047E-01      
 16      1.8230000E+00         -2.50861102182E-01      
S   1
  1      9.1470000E-01          1.0000000        
S   1
  1      3.3930000E-01          1.0000000        
S   1
  1      1.5000000E-01          1.0000000        
S   1
  1      6.4380000E-02          1.0000000        
P   8
  1      1.7800000E+03          2.32825005577E-04      
  2      4.2180000E+02          1.82172668533E-03      
  3      1.3670000E+02          9.65997214356E-03      
  4      5.1810000E+01          3.75381462929E-02      
  5      2.1600000E+01          1.11165326545E-01      
  6      9.5630000E+00          2.38121785167E-01      
  7      4.3500000E+00          3.53500947506E-01      
  8      2.0060000E+00          3.28352505697E-01      
P   8
  1      1.7800000E+03         -4.91339655643E-05      
  2      4.2180000E+02         -3.90098705743E-04      
  3      1.3670000E+02         -2.04658722725E-03      
  4      5.1810000E+01         -8.14432685878E-03      
  5      2.1600000E+01         -2.41442483149E-02      
  6      9.5630000E+00         -5.40768949902E-02      
  7      4.3500000E+00         -7.92354431520E-02      
  8      2.0060000E+00         -8.84741176520E-02      
P   1
  1      9.2050000E-01          1.0000000        
P   1
  1      3.5000000E-01          1.0000000        
P   1
  1      1.3810000E-01          1.0000000        
P   1
  1      5.3380000E-02          1.0000000        
D   1
  1      2.0820000E+00          1.0000000        
D   1
  1      8.1700000E-01          1.0000000        
D   1
  1      3.2100000E-01          1.0000000        
D   1
  1      1.2600000E-01          1.0000000        
F   1
  1      6.8800000E-01          1.0000000        
F   1
  1      3.4100000E-01          1.0000000        
F   1
  1      1.6900000E-01          1.0000000        
G   1
  1      7.0500000E-01          1.0000000        
G   1
  1      3.2000000E-01          1.0000000        
H   1
  1      5.8300000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: P
data:
PHOSPHOROUS
S   16
  1      4.6660000E+06          5.32214956632E-06      
  2      6.9860000E+05          2.47972979377E-05      
  3      1.5900000E+05          1.05469801123E-04      
  4      4.5040000E+04          3.96713233036E-04      
  5      1.4720000E+04          1.35506080682E-03      
  6      5.3230000E+03          4.25627179246E-03      
  7      2.0760000E+03          1.23615129793E-02      
  8      8.6110000E+02          3.29902852919E-02      
  9      3.7570000E+02          7.96714080370E-02      
 10      1.7080000E+02          1.67365229728E-01      
 11      8.0290000E+01          2.82989881064E-01      
 12      3.8770000E+01          3.30333235567E-01      
 13      1.8930000E+01          2.01577637443E-01      
 14      8.7960000E+00          3.78527046442E-02      
 15      4.3580000E+00         -3.75344577390E-04      
 16      2.1740000E+00          1.56527108391E-03      
S   16
  1      4.6660000E+06         -1.45361155094E-06      
  2      6.9860000E+05         -6.77988717753E-06      
  3      1.5900000E+05         -2.88402581808E-05      
  4      4.5040000E+04         -1.08619728813E-04      
  5      1.4720000E+04         -3.71138469906E-04      
  6      5.3230000E+03         -1.17033959556E-03      
  7      2.0760000E+03         -3.41738172259E-03      
  8      8.6110000E+02         -9.27651718708E-03      
  9      3.7570000E+02         -2.31109796684E-02      
 10      1.7080000E+02         -5.21047880917E-02      
 11      8.0290000E+01         -1.00755891714E-01      
 12      3.8770000E+01         -1.54937916474E-01      
 13      1.8930000E+01         -1.31702959328E-01      
 14      8.7960000E+00          9.14500911281E-02      
 15      4.3580000E+00          4.24321105529E-01      
 16      2.1740000E+00          4.72532471244E-01      
S   16
  1      4.6660000E+06          4.00862444227E-07      
  2      6.9860000E+05          1.86897044118E-06      
  3      1.5900000E+05          7.95696236172E-06      
  4      4.5040000E+04          2.99344411639E-05      
  5      1.4720000E+04          1.02453691399E-04      
  6      5.3230000E+03          3.22510754903E-04      
  7      2.0760000E+03          9.44581401093E-04      
  8      8.6110000E+02          2.55994622867E-03      
  9      3.7570000E+02          6.41895470954E-03      
 10      1.7080000E+02          1.44953388425E-02      
 11      8.0290000E+01          2.85433045140E-02      
 12      3.8770000E+01          4.46537734426E-02      
 13      1.8930000E+01          4.01879148119E-02      
 14      8.7960000E+00         -3.15438566340E-02      
 15      4.3580000E+00         -1.54697159746E-01      
 16      2.1740000E+00         -2.83454816689E-01      
S   1
  1      1.0950000E+00          1.0000000        
S   1
  1      4.4000000E-01          1.0000000        
S   1
  1      1.9450000E-01          1.0000000        
S   1
  1      8.3760000E-02          1.0000000        
P   8
  1      2.0100000E+03          2.54380015638E-04      
  2      4.7630000E+02          1.96368955908E-03      
  3      1.5440000E+02          1.03927616544E-02      
  4      5.8510000E+01          4.03627938978E-02      
  5      2.4400000E+01          1.19046399872E-01      
  6      1.0800000E+01          2.52022045326E-01      
  7      4.9130000E+00          3.66255842314E-01      
  8      2.2690000E+00          3.15493790595E-01      
P   8
  1      2.0100000E+03         -5.99109313415E-05      
  2      4.7630000E+02         -4.66519559803E-04      
  3      1.5440000E+02         -2.46017535903E-03      
  4      5.8510000E+01         -9.72979002731E-03      
  5      2.4400000E+01         -2.90293626716E-02      
  6      1.0800000E+01         -6.37850702718E-02      
  7      4.9130000E+00         -9.38537620321E-02      
  8      2.2690000E+00         -9.26604513352E-02      
P   1
  1      1.0430000E+00          1.0000000        
P   1
  1      4.3130000E-01          1.0000000        
P   1
  1      1.7670000E-01          1.0000000        
P   1
  1      7.0090000E-02          1.0000000        
D   1
  1      2.6560000E+00          1.0000000        
D   1
  1      1.0540000E+00          1.0000000        
D   1
  1      4.1800000E-01          1.0000000        
D   1
  1      1.6600000E-01          1.0000000        
F   1
  1      9.2300000E-01          1.0000000        
F   1
  1      4.5000000E-01          1.0000000        
F   1
  1      2.1900000E-01          1.0000000        
G   1
  1      9.0300000E-01          1.0000000        
G   1
  1      4.1200000E-01          1.0000000        
H   1
  1      7.4500000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: S
data:
SULFUR
S   16
  1      5.4810000E+06          5.64227132479E-06      
  2      8.2060000E+05          2.53301213081E-05      
  3      1.8670000E+05          1.05394480225E-04      
  4      5.2880000E+04          3.90799339945E-04      
  5      1.7250000E+04          1.33038572349E-03      
  6      6.2260000E+03          4.15559206587E-03      
  7      2.4290000E+03          1.20363677150E-02      
  8      1.0070000E+03          3.21061323646E-02      
  9      4.3950000E+02          7.75794287431E-02      
 10      1.9980000E+02          1.63752770387E-01      
 11      9.3920000E+01          2.79324755514E-01      
 12      4.5340000E+01          3.31353393348E-01      
 13      2.2150000E+01          2.07774091329E-01      
 14      1.0340000E+01          4.10309872973E-02      
 15      5.1190000E+00         -4.40189148176E-04      
 16      2.5530000E+00          1.66282435741E-03      
S   16
  1      5.4810000E+06         -1.56877155636E-06      
  2      8.2060000E+05         -7.05050486247E-06      
  3      1.8670000E+05         -2.93456620596E-05      
  4      5.2880000E+04         -1.08943006352E-04      
  5      1.7250000E+04         -3.71083620315E-04      
  6      6.2260000E+03         -1.16334728868E-03      
  7      2.4290000E+03         -3.38847056358E-03      
  8      1.0070000E+03         -9.18752074650E-03      
  9      4.3950000E+02         -2.29002917320E-02      
 10      1.9980000E+02         -5.17942536997E-02      
 11      9.3920000E+01         -1.00892776881E-01      
 12      4.5340000E+01         -1.56655046394E-01      
 13      2.2150000E+01         -1.37327590014E-01      
 14      1.0340000E+01          8.51995254335E-02      
 15      5.1190000E+00          4.32894308694E-01      
 16      2.5530000E+00          4.78764077217E-01      
S   16
  1      5.4810000E+06          4.55958006657E-07      
  2      8.2060000E+05          2.04863464803E-06      
  3      1.8670000E+05          8.53283973246E-06      
  4      5.2880000E+04          3.16491775986E-05      
  5      1.7250000E+04          1.07954824908E-04      
  6      6.2260000E+03          3.37971193163E-04      
  7      2.4290000E+03          9.86986817141E-04      
  8      1.0070000E+03          2.67329140285E-03      
  9      4.3950000E+02          6.70292753998E-03      
 10      1.9980000E+02          1.51996488237E-02      
 11      9.3920000E+01          3.01318000119E-02      
 12      4.5340000E+01          4.77106564323E-02      
 13      2.2150000E+01          4.41987668835E-02      
 14      1.0340000E+01         -3.09201868962E-02      
 15      5.1190000E+00         -1.70477688013E-01      
 16      2.5530000E+00         -3.11098270295E-01      
S   1
  1      1.2820000E+00          1.0000000        
S   1
  1      5.4500000E-01          1.0000000        
S   1
  1      2.4110000E-01          1.0000000        
S   1
  1      1.0350000E-01          1.0000000        
P   8
  1      2.2000000E+03          2.86088222322E-04      
  2      5.2140000E+02          2.18560730308E-03      
  3      1.6900000E+02          1.15063037376E-02      
  4      6.4050000E+01          4.45369071290E-02      
  5      2.6720000E+01          1.29757066265E-01      
  6      1.1830000E+01          2.69316968300E-01      
  7      5.3780000E+00          3.78213059101E-01      
  8      2.4820000E+00          2.96007498028E-01      
P   8
  1      2.2000000E+03         -7.28392073638E-05      
  2      5.2140000E+02         -5.58113144309E-04      
  3      1.6900000E+02         -2.94844211744E-03      
  4      6.4050000E+01         -1.15588165438E-02      
  5      2.6720000E+01         -3.44243410366E-02      
  6      1.1830000E+01         -7.35723994891E-02      
  7      5.3780000E+00         -1.07640102038E-01      
  8      2.4820000E+00         -8.73184163376E-02      
P   1
  1      1.1160000E+00          1.0000000        
P   1
  1      4.8480000E-01          1.0000000        
P   1
  1      2.0060000E-01          1.0000000        
P   1
  1      7.9510000E-02          1.0000000        
D   1
  1      3.2030000E+00          1.0000000        
D   1
  1      1.2810000E+00          1.0000000        
D   1
  1      5.1200000E-01          1.0000000        
D   1
  1      2.0500000E-01          1.0000000        
F   1
  1      1.0960000E+00          1.0000000        
F   1
  1      5.2900000E-01          1.0000000        
F   1
  1      2.5500000E-01          1.0000000        
G   1
  1      1.0710000E+00          1.0000000        
G   1
  1      4.6300000E-01          1.0000000        
H   1
  1      8.7200000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   16
  1      6.4100000E+06          5.96043707185E-06      
  2      9.5960000E+05          2.58375982484E-05      
  3      2.1830000E+05          1.05030225692E-04      
  4      6.1810000E+04          3.84362173743E-04      
  5      2.0140000E+04          1.29752371590E-03      
  6      7.2640000E+03          4.03940953433E-03      
  7      2.8320000E+03          1.16512912866E-02      
  8      1.1750000E+03          3.10383976919E-02      
  9      5.1260000E+02          7.51961622955E-02      
 10      2.3300000E+02          1.59470150584E-01      
 11      1.0950000E+02          2.74823438623E-01      
 12      5.2860000E+01          3.32102170415E-01      
 13      2.5840000E+01          2.15210269939E-01      
 14      1.2170000E+01          4.50311903173E-02      
 15      6.0300000E+00         -1.28080321292E-04      
 16      3.0120000E+00          1.61047619756E-03      
S   16
  1      6.4100000E+06         -1.68312337195E-06      
  2      9.5960000E+05         -7.30460595779E-06      
  3      2.1830000E+05         -2.97083809158E-05      
  4      6.1810000E+04         -1.08845509333E-04      
  5      2.0140000E+04         -3.67712107036E-04      
  6      7.2640000E+03         -1.14868852941E-03      
  7      2.8320000E+03         -3.33216932223E-03      
  8      1.1750000E+03         -9.01751997290E-03      
  9      5.1260000E+02         -2.25268541679E-02      
 10      2.3300000E+02         -5.10975543318E-02      
 11      1.0950000E+02         -1.00325420267E-01      
 12      5.2860000E+01         -1.57528929548E-01      
 13      2.5840000E+01         -1.43336293664E-01      
 14      1.2170000E+01          7.40293036072E-02      
 15      6.0300000E+00          4.32865873818E-01      
 16      3.0120000E+00          4.87393426868E-01      
S   16
  1      6.4100000E+06          5.09439478141E-07      
  2      9.5960000E+05          2.21048638685E-06      
  3      2.1830000E+05          8.99562012445E-06      
  4      6.1810000E+04          3.29344567197E-05      
  5      2.0140000E+04          1.11395318692E-04      
  6      7.2640000E+03          3.47598590893E-04      
  7      2.8320000E+03          1.01067015788E-03      
  8      1.1750000E+03          2.73326671856E-03      
  9      5.1260000E+02          6.86591272266E-03      
 10      2.3300000E+02          1.56251825623E-02      
 11      1.0950000E+02          3.12048789959E-02      
 12      5.2860000E+01          5.00456727941E-02      
 13      2.5840000E+01          4.80641488182E-02      
 14      1.2170000E+01         -2.80028900936E-02      
 15      6.0300000E+00         -1.80162606373E-01      
 16      3.0120000E+00         -3.31932030553E-01      
S   1
  1      1.5110000E+00          1.0000000        
S   1
  1      6.6040000E-01          1.0000000        
S   1
  1      2.9260000E-01          1.0000000        
S   1
  1      1.2540000E-01          1.0000000        
P   8
  1      2.5480000E+03          2.89374035826E-04      
  2      6.0370000E+02          2.17605117556E-03      
  3      1.9560000E+02          1.14666616495E-02      
  4      7.4150000E+01          4.45324402060E-02      
  5      3.0940000E+01          1.30706671695E-01      
  6      1.3690000E+01          2.73281479083E-01      
  7      6.2290000E+00          3.83257858090E-01      
  8      2.8780000E+00          2.90979067824E-01      
P   8
  1      2.5480000E+03         -7.80241434829E-05      
  2      6.0370000E+02         -5.87032153435E-04      
  3      1.9560000E+02         -3.11370872623E-03      
  4      7.4150000E+01         -1.22185952651E-02      
  5      3.0940000E+01         -3.68358077520E-02      
  6      1.3690000E+01         -7.91279822493E-02      
  7      6.2290000E+00         -1.17221965646E-01      
  8      2.8780000E+00         -8.54644214395E-02      
P   1
  1      1.2820000E+00          1.0000000        
P   1
  1      5.6410000E-01          1.0000000        
P   1
  1      2.3480000E-01          1.0000000        
P   1
  1      9.3120000E-02          1.0000000        
D   1
  1      3.7810000E+00          1.0000000        
D   1
  1      1.5290000E+00          1.0000000        
D   1
  1      6.1800000E-01          1.0000000        
D   1
  1      2.5000000E-01          1.0000000        
F   1
  1      1.3450000E+00          1.0000000        
F   1
  1      6.5600000E-01          1.0000000        
F   1
  1      3.2000000E-01          1.0000000        
G   1
  1      1.3020000E+00          1.0000000        
G   1
  1      5.5600000E-01          1.0000000        
H   1
  1      1.0530000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ar
data:
ARGON
S   16
  1      7.4010000E+06          6.32718817114E-06      
  2      1.1080000E+06          2.65395280323E-05      
  3      2.5210000E+05          1.05536917634E-04      
  4      7.1380000E+04          3.80315610567E-04      
  5      2.3260000E+04          1.27227766636E-03      
  6      8.3900000E+03          3.93728266833E-03      
  7      3.2710000E+03          1.13263790354E-02      
  8      1.3570000E+03          3.01273236299E-02      
  9      5.9200000E+02          7.30887331606E-02      
 10      2.6910000E+02          1.55521565044E-01      
 11      1.2650000E+02          2.70569151170E-01      
 12      6.1030000E+01          3.32719373054E-01      
 13      2.9860000E+01          2.21630823970E-01      
 14      1.4170000E+01          4.91578085326E-02      
 15      7.0220000E+00          6.52871171958E-05      
 16      3.5110000E+00          1.65430650969E-03      
S   16
  1      7.4010000E+06         -1.81120088488E-06      
  2      1.1080000E+06         -7.60643621521E-06      
  3      2.5210000E+05         -3.02690384367E-05      
  4      7.1380000E+04         -1.09200228227E-04      
  5      2.3260000E+04         -3.65660325531E-04      
  6      8.3900000E+03         -1.13521778611E-03      
  7      3.2710000E+03         -3.28481427082E-03      
  8      1.3570000E+03         -8.87030699929E-03      
  9      5.9200000E+02         -2.21840841773E-02      
 10      2.6910000E+02         -5.03985345882E-02      
 11      1.2650000E+02         -9.96885443566E-02      
 12      6.1030000E+01         -1.58226164582E-01      
 13      2.9860000E+01         -1.48450084327E-01      
 14      1.4170000E+01          6.37169706738E-02      
 15      7.0220000E+00          4.32358738344E-01      
 16      3.5110000E+00          4.95165179520E-01      
S   16
  1      7.4010000E+06          5.66288410744E-07      
  2      1.1080000E+06          2.37792246982E-06      
  3      2.5210000E+05          9.46757262889E-06      
  4      7.1380000E+04          3.41364150510E-05      
  5      2.3260000E+04          1.14423151568E-04      
  6      8.3900000E+03          3.54924321646E-04      
  7      3.2710000E+03          1.02909547203E-03      
  8      1.3570000E+03          2.77812446348E-03      
  9      5.9200000E+02          6.98388625950E-03      
 10      2.6910000E+02          1.59279645479E-02      
 11      1.2650000E+02          3.20295938185E-02      
 12      6.1030000E+01          5.19955237209E-02      
 13      2.9860000E+01          5.14312936548E-02      
 14      1.4170000E+01         -2.48943585380E-02      
 15      7.0220000E+00         -1.88242389137E-01      
 16      3.5110000E+00         -3.49490766011E-01      
S   1
  1      1.7580000E+00          1.0000000        
S   1
  1      7.8410000E-01          1.0000000        
S   1
  1      3.4800000E-01          1.0000000        
S   1
  1      1.4910000E-01          1.0000000        
P   8
  1      2.9270000E+03          2.92642824442E-04      
  2      6.9350000E+02          2.16407846751E-03      
  3      2.2470000E+02          1.13899497882E-02      
  4      8.5170000E+01          4.44759274918E-02      
  5      3.5530000E+01          1.31195375185E-01      
  6      1.5730000E+01          2.76149198706E-01      
  7      7.1650000E+00          3.87134177743E-01      
  8      3.3220000E+00          2.86344159403E-01      
P   8
  1      2.9270000E+03         -8.18900061942E-05      
  2      6.9350000E+02         -6.04996843683E-04      
  3      2.2470000E+02         -3.21165281847E-03      
  4      8.5170000E+01         -1.26553399563E-02      
  5      3.5530000E+01         -3.84744680378E-02      
  6      1.5730000E+01         -8.31589266505E-02      
  7      7.1650000E+00         -1.24354536068E-01      
  8      3.3220000E+00         -8.24856190475E-02      
P   1
  1      1.4780000E+00          1.0000000        
P   1
  1      6.5520000E-01          1.0000000        
P   1
  1      2.7510000E-01          1.0000000        
P   1
  1      1.0970000E-01          1.0000000        
D   1
  1      4.7760000E+00          1.0000000        
D   1
  1      1.9170000E+00          1.0000000        
D   1
  1      7.7000000E-01          1.0000000        
D   1
  1      3.0900000E-01          1.0000000        
F   1
  1      1.6680000E+00          1.0000000        
F   1
  1      8.2500000E-01          1.0000000        
F   1
  1      4.0800000E-01          1.0000000        
G   1
  1      1.5620000E+00          1.0000000        
G   1
  1      6.6500000E-01          1.0000000        
H   1
  1      1.2640000E+00          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ga
data:
GALLIUM
S   22
  1      1.0861522E+08          4.85687547324E-06      
  2      1.6264540E+07          1.45588798736E-05      
  3      3.7001116E+06          4.24333430591E-05      
  4      1.0471691E+06          1.14343295922E-04      
  5      3.4106757E+05          3.06674700291E-04      
  6      1.2277154E+05          8.09143869558E-04      
  7      4.7659578E+04          2.11038504289E-03      
  8      1.9633354E+04          5.38280204329E-03      
  9      8.4887347E+03          1.33184740868E-02      
 10      3.8231381E+03          3.15135851426E-02      
 11      1.7844755E+03          6.97608591466E-02      
 12      8.6005305E+02          1.39286838536E-01      
 13      4.2669867E+02          2.35735951208E-01      
 14      2.1726161E+02          3.03148193052E-01      
 15      1.1296987E+02          2.44894603206E-01      
 16      5.9449441E+01          9.15959246396E-02      
 17      3.0782256E+01          9.21113974756E-03      
 18      1.6423212E+01          5.64012080220E-04      
 19      8.7578890E+00         -5.79358164091E-05      
 20      4.4096290E+00          1.23410653419E-05      
 21      2.2494490E+00         -6.15550006521E-05      
 22      1.1261150E+00          1.61985934975E-05      
S   22
  1      1.0861522E+08         -1.53947161877E-06      
  2      1.6264540E+07         -4.62052757984E-06      
  3      3.7001116E+06         -1.34905242164E-05      
  4      1.0471691E+06         -3.64257988664E-05      
  5      3.4106757E+05         -9.79308512690E-05      
  6      1.2277154E+05         -2.58926672486E-04      
  7      4.7659578E+04         -6.77428768544E-04      
  8      1.9633354E+04         -1.73434545253E-03      
  9      8.4887347E+03         -4.32681453698E-03      
 10      3.8231381E+03         -1.03897503927E-02      
 11      1.7844755E+03         -2.37395362401E-02      
 12      8.6005305E+02         -5.02965042759E-02      
 13      4.2669867E+02         -9.56296457360E-02      
 14      2.1726161E+02         -1.51047928858E-01      
 15      1.1296987E+02         -1.65775551643E-01      
 16      5.9449441E+01         -2.79800759076E-02      
 17      3.0782256E+01          3.13242735575E-01      
 18      1.6423212E+01          5.22138525982E-01      
 19      8.7578890E+00          2.84930486592E-01      
 20      4.4096290E+00          4.10765830202E-02      
 21      2.2494490E+00          1.31855778921E-03      
 22      1.1261150E+00          1.06928260505E-03      
S   22
  1      1.0861522E+08          5.89260195489E-07      
  2      1.6264540E+07          1.76879042837E-06      
  3      3.7001116E+06          5.16583528738E-06      
  4      1.0471691E+06          1.39500169567E-05      
  5      3.4106757E+05          3.75230129320E-05      
  6      1.2277154E+05          9.92081660681E-05      
  7      4.7659578E+04          2.59754158667E-04      
  8      1.9633354E+04          6.65017303876E-04      
  9      8.4887347E+03          1.66174972885E-03      
 10      3.8231381E+03          3.99489834709E-03      
 11      1.7844755E+03          9.17214547498E-03      
 12      8.6005305E+02          1.95609653883E-02      
 13      4.2669867E+02          3.78086192386E-02      
 14      2.1726161E+02          6.13214441274E-02      
 15      1.1296987E+02          7.07629000978E-02      
 16      5.9449441E+01          1.16949705826E-02      
 17      3.0782256E+01         -1.73217978712E-01      
 18      1.6423212E+01         -4.04998339387E-01      
 19      8.7578890E+00         -2.72335324685E-01      
 20      4.4096290E+00          2.96460236596E-01      
 21      2.2494490E+00          6.35306454980E-01      
 22      1.1261150E+00          3.50219250895E-01      
S   22
  1      1.0861522E+08         -1.38226081271E-07      
  2      1.6264540E+07         -4.14932645034E-07      
  3      3.7001116E+06         -1.21181763788E-06      
  4      1.0471691E+06         -3.27275682493E-06      
  5      3.4106757E+05         -8.80259645574E-06      
  6      1.2277154E+05         -2.32775303287E-05      
  7      4.7659578E+04         -6.09384877254E-05      
  8      1.9633354E+04         -1.56060919225E-04      
  9      8.4887347E+03         -3.89903737208E-04      
 10      3.8231381E+03         -9.37907178560E-04      
 11      1.7844755E+03         -2.15361941607E-03      
 12      8.6005305E+02         -4.59997625007E-03      
 13      4.2669867E+02         -8.90305100235E-03      
 14      2.1726161E+02         -1.45083379284E-02      
 15      1.1296987E+02         -1.68197322127E-02      
 16      5.9449441E+01         -2.83868185529E-03      
 17      3.0782256E+01          4.28266373614E-02      
 18      1.6423212E+01          1.04694989705E-01      
 19      8.7578890E+00          7.22494632611E-02      
 20      4.4096290E+00         -9.39038017635E-02      
 21      2.2494490E+00         -2.28709121592E-01      
 22      1.1261150E+00         -2.47677401825E-01      
S   1
  1      5.1548600E-01          1.0000000        
S   1
  1      2.4257800E-01          1.0000000        
S   1
  1      1.0708600E-01          1.0000000        
S   1
  1      4.6988000E-02          1.0000000        
P   13
  1      3.2152190E+04          1.01440620478E-04      
  2      7.6093842E+03          4.03595870955E-04      
  3      2.4714744E+03          1.86837342207E-03      
  4      9.4606363E+02          7.39445846857E-03      
  5      4.0194711E+02          2.54681116637E-02      
  6      1.8364688E+02          7.34886379737E-02      
  7      8.8533264E+01          1.70464507057E-01      
  8      4.4270355E+01          2.96947286264E-01      
  9      2.2723083E+01          3.46312483199E-01      
 10      1.1823141E+01          2.13663763575E-01      
 11      6.0421350E+00          5.06883489941E-02      
 12      3.0317540E+00          3.30955262180E-03      
 13      1.4933660E+00          9.70249446399E-04      
P   13
  1      3.2152190E+04         -3.86023172065E-05      
  2      7.6093842E+03         -1.53759931254E-04      
  3      2.4714744E+03         -7.14461291095E-04      
  4      9.4606363E+02         -2.83935015074E-03      
  5      4.0194711E+02         -9.90331950129E-03      
  6      1.8364688E+02         -2.91883691764E-02      
  7      8.8533264E+01         -7.03386795762E-02      
  8      4.4270355E+01         -1.28139405429E-01      
  9      2.2723083E+01         -1.57084451826E-01      
 10      1.1823141E+01         -3.74737504294E-02      
 11      6.0421350E+00          2.49052968403E-01      
 12      3.0317540E+00          4.46468621061E-01      
 13      1.4933660E+00          3.48193557775E-01      
P   13
  1      3.2152190E+04          6.28380271613E-06      
  2      7.6093842E+03          2.51818288642E-05      
  3      2.4714744E+03          1.16019340898E-04      
  4      9.4606363E+02          4.65965395632E-04      
  5      4.0194711E+02          1.60959872265E-03      
  6      1.8364688E+02          4.81081365253E-03      
  7      8.8533264E+01          1.14810577710E-02      
  8      4.4270355E+01          2.14003029664E-02      
  9      2.2723083E+01          2.55975450395E-02      
 10      1.1823141E+01          5.72389915355E-03      
 11      6.0421350E+00         -5.10709436375E-02      
 12      3.0317540E+00         -8.42053818029E-02      
 13      1.4933660E+00         -8.93261215128E-02      
P   1
  1      7.0972700E-01          1.0000000        
P   1
  1      2.4859300E-01          1.0000000        
P   1
  1      9.4395000E-02          1.0000000        
P   1
  1      3.5887000E-02          1.0000000        
D   9
  1      1.0405046E+03          1.02369759691E-04      
  2      3.1459714E+02          9.03617265467E-04      
  3      1.2278760E+02          5.10231396445E-03      
  4      5.4760369E+01          2.00100995711E-02      
  5      2.6298944E+01          5.80884899975E-02      
  6      1.3263445E+01          1.30926416590E-01      
  7      6.8850650E+00          2.20607877212E-01      
  8      3.5795250E+00          2.81361651009E-01      
  9      1.8315640E+00          2.83093354188E-01      
D   1
  1      9.1290900E-01          1.0000000        
D   1
  1      4.3534000E-01          1.0000000        
D   1
  1      1.8851800E-01          1.0000000        
D   1
  1      7.5800000E-02          1.0000000        
F   1
  1      5.9600000E-01          1.0000000        
F   1
  1      2.8260000E-01          1.0000000        
F   1
  1      1.3400000E-01          1.0000000        
G   1
  1      6.1460000E-01          1.0000000        
G   1
  1      2.7500000E-01          1.0000000        
H   1
  1      4.9860000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Ge
data:
GERMANIUM
S   22
  1      1.2200119E+08          5.01225193249E-06      
  2      1.8257470E+07          1.48967329031E-05      
  3      4.1508215E+06          4.29632977123E-05      
  4      1.1741018E+06          1.14252981603E-04      
  5      3.8230915E+05          3.02408466611E-04      
  6      1.3760796E+05          7.88282916768E-04      
  7      5.3419242E+04          2.03627632022E-03      
  8      2.2005756E+04          5.15681991332E-03      
  9      9.5138479E+03          1.27004082842E-02      
 10      4.2841756E+03          2.99891934890E-02      
 11      1.9991664E+03          6.64525190704E-02      
 12      9.6324716E+02          1.33366531268E-01      
 13      4.7780500E+02          2.28328808938E-01      
 14      2.4331589E+02          3.00375426246E-01      
 15      1.2663999E+02          2.53147976769E-01      
 16      6.6783579E+01          1.02472236816E-01      
 17      3.4416084E+01          1.18399282731E-02      
 18      1.8372814E+01          3.76728657771E-04      
 19      9.8054610E+00          6.85540238422E-05      
 20      4.9694030E+00         -4.56861375313E-05      
 21      2.5486230E+00         -3.15536453710E-05      
 22      1.2845940E+00         -3.97974339072E-07      
S   22
  1      1.2200119E+08         -1.59650949261E-06      
  2      1.8257470E+07         -4.75086718406E-06      
  3      4.1508215E+06         -1.37262402318E-05      
  4      1.1741018E+06         -3.65781036493E-05      
  5      3.8230915E+05         -9.70629880176E-05      
  6      1.3760796E+05         -2.53564711474E-04      
  7      5.3419242E+04         -6.57143765050E-04      
  8      2.2005756E+04         -1.67027328989E-03      
  9      9.5138479E+03         -4.14719960369E-03      
 10      4.2841756E+03         -9.93037498763E-03      
 11      1.9991664E+03         -2.26850369855E-02      
 12      9.6324716E+02         -4.81707687192E-02      
 13      4.7780500E+02         -9.21944957289E-02      
 14      2.4331589E+02         -1.47609376927E-01      
 15      1.2663999E+02         -1.68277667825E-01      
 16      6.6783579E+01         -4.44829351658E-02      
 17      3.4416084E+01          2.89578359468E-01      
 18      1.8372814E+01          5.23293469490E-01      
 19      9.8054610E+00          3.06656005016E-01      
 20      4.9694030E+00          4.85149413367E-02      
 21      2.5486230E+00          1.47626994494E-03      
 22      1.2845940E+00          1.18991245165E-03      
S   22
  1      1.2200119E+08          6.17473190332E-07      
  2      1.8257470E+07          1.83768360993E-06      
  3      4.1508215E+06          5.31099145379E-06      
  4      1.1741018E+06          1.41549652471E-05      
  5      3.8230915E+05          3.75797789709E-05      
  6      1.3760796E+05          9.81746313312E-05      
  7      5.3419242E+04          2.54620933889E-04      
  8      2.2005756E+04          6.47193274525E-04      
  9      9.5138479E+03          1.60945163376E-03      
 10      4.2841756E+03          3.85818307307E-03      
 11      1.9991664E+03          8.85474635789E-03      
 12      9.6324716E+02          1.89225588551E-02      
 13      4.7780500E+02          3.67938555272E-02      
 14      2.4331589E+02          6.04349636847E-02      
 15      1.2663999E+02          7.23419168703E-02      
 16      6.6783579E+01          1.94365293195E-02      
 17      3.4416084E+01         -1.60299751285E-01      
 18      1.8372814E+01         -4.01413337123E-01      
 19      9.8054610E+00         -2.99693911964E-01      
 20      4.9694030E+00          2.61727424598E-01      
 21      2.5486230E+00          6.43317633486E-01      
 22      1.2845940E+00          3.74736145139E-01      
S   22
  1      1.2200119E+08         -1.59565417100E-07      
  2      1.8257470E+07         -4.74891221907E-07      
  3      4.1508215E+06         -1.37253704312E-06      
  4      1.1741018E+06         -3.65808252122E-06      
  5      3.8230915E+05         -9.71287241440E-06      
  6      1.3760796E+05         -2.53726704762E-05      
  7      5.3419242E+04         -6.58177927418E-05      
  8      2.2005756E+04         -1.67277192567E-04      
  9      9.5138479E+03         -4.16134361664E-04      
 10      4.2841756E+03         -9.97551076842E-04      
 11      1.9991664E+03         -2.29136261307E-03      
 12      9.6324716E+02         -4.89975674752E-03      
 13      4.7780500E+02         -9.55117197297E-03      
 14      2.4331589E+02         -1.57373036593E-02      
 15      1.2663999E+02         -1.89803615158E-02      
 16      6.6783579E+01         -5.10554178475E-03      
 17      3.4416084E+01          4.35313251683E-02      
 18      1.8372814E+01          1.14749036588E-01      
 19      9.8054610E+00          8.76995667019E-02      
 20      4.9694030E+00         -9.09904021189E-02      
 21      2.5486230E+00         -2.58981973424E-01      
 22      1.2845940E+00         -2.89798359116E-01      
S   1
  1      5.8335300E-01          1.0000000        
S   1
  1      2.9343900E-01          1.0000000        
S   1
  1      1.3267200E-01          1.0000000        
S   1
  1      5.9239000E-02          1.0000000        
P   13
  1      3.2314970E+04          1.14280377836E-04      
  2      7.6482002E+03          4.53323565182E-04      
  3      2.4842114E+03          2.09055288113E-03      
  4      9.5100305E+02          8.23326316792E-03      
  5      4.0404833E+02          2.81785793109E-02      
  6      1.8460354E+02          8.04769992673E-02      
  7      8.8964128E+01          1.83363457151E-01      
  8      4.4447742E+01          3.10269252528E-01      
  9      2.2799075E+01          3.42323377118E-01      
 10      1.1835928E+01          1.92308443523E-01      
 11      6.0112940E+00          3.97089083304E-02      
 12      2.9957840E+00          2.32108143233E-03      
 13      1.4695700E+00          7.91504520997E-04      
P   13
  1      3.2314970E+04         -4.41520087698E-05      
  2      7.6482002E+03         -1.75386156700E-04      
  3      2.4842114E+03         -8.11860616050E-04      
  4      9.5100305E+02         -3.21254488239E-03      
  5      4.0404833E+02         -1.11417643416E-02      
  6      1.8460354E+02         -3.25600507325E-02      
  7      8.8964128E+01         -7.71752984246E-02      
  8      4.4447742E+01         -1.36947121562E-01      
  9      2.2799075E+01         -1.56858511046E-01      
 10      1.1835928E+01         -9.17373351045E-03      
 11      6.0112940E+00          2.91793003925E-01      
 12      2.9957840E+00          4.62037912836E-01      
 13      1.4695700E+00          3.11313516874E-01      
P   13
  1      3.2314970E+04          8.62795964580E-06      
  2      7.6482002E+03          3.43549383488E-05      
  3      2.4842114E+03          1.58563022501E-04      
  4      9.5100305E+02          6.30167001325E-04      
  5      4.0404833E+02          2.17963822703E-03      
  6      1.8460354E+02          6.41460426114E-03      
  7      8.8964128E+01          1.51904870200E-02      
  8      4.4447742E+01          2.73045003054E-02      
  9      2.2799075E+01          3.10270012509E-02      
 10      1.1835928E+01         -3.90002315144E-04      
 11      6.0112940E+00         -7.04177126680E-02      
 12      2.9957840E+00         -1.11137036279E-01      
 13      1.4695700E+00         -9.66649432109E-02      
P   1
  1      6.9068100E-01          1.0000000        
P   1
  1      2.8616000E-01          1.0000000        
P   1
  1      1.1774200E-01          1.0000000        
P   1
  1      4.7385000E-02          1.0000000        
D   9
  1      1.2267982E+03          8.94245812229E-05      
  2      3.7123223E+02          7.84736148611E-04      
  3      1.4489099E+02          4.47857722773E-03      
  4      6.4604130E+01          1.80157442222E-02      
  5      3.1039737E+01          5.37746000869E-02      
  6      1.5643870E+01          1.25062774092E-01      
  7      8.1258220E+00          2.17939338975E-01      
  8      4.2397620E+00          2.84887954693E-01      
  9      2.1863860E+00          2.89487122058E-01      
D   1
  1      1.1038710E+00          1.0000000        
D   1
  1      5.3381100E-01          1.0000000        
D   1
  1      2.3135500E-01          1.0000000        
D   1
  1      9.5300000E-02          1.0000000        
F   1
  1      6.7090000E-01          1.0000000        
F   1
  1      3.2970000E-01          1.0000000        
F   1
  1      1.6300000E-01          1.0000000        
G   1
  1      7.0340000E-01          1.0000000        
G   1
  1      3.1600000E-01          1.0000000        
H   1
  1      5.8150000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: As
data:
ARSENIC
S   22
  1      1.3750753E+08          5.14914015661E-06      
  2      2.0515052E+07          1.52282040261E-05      
  3      4.6487164E+06          4.35803308760E-05      
  4      1.3112646E+06          1.14667015744E-04      
  5      4.2618586E+05          2.99973893037E-04      
  6      1.5323706E+05          7.73224542050E-04      
  7      5.9459404E+04          1.97833442402E-03      
  8      2.4492812E+04          4.97262259121E-03      
  9      1.0590253E+04          1.21830142042E-02      
 10      4.7697841E+03          2.86802657042E-02      
 11      2.2263698E+03          6.35277053032E-02      
 12      1.0730862E+03          1.27943247379E-01      
 13      5.3250059E+02          2.21187243102E-01      
 14      2.7129755E+02          2.97051429174E-01      
 15      1.4131195E+02          2.60382441361E-01      
 16      7.4584433E+01          1.13173105262E-01      
 17      3.8298338E+01          1.46748679983E-02      
 18      2.0469130E+01          2.01889298495E-04      
 19      1.0939578E+01          1.99237155770E-04      
 20      5.5903670E+00         -1.07865507663E-04      
 21      2.8828590E+00          1.26350487207E-06      
 22      1.4660860E+00         -1.91629286666E-05      
S   22
  1      1.3750753E+08         -1.64788194277E-06      
  2      2.0515052E+07         -4.87952140988E-06      
  3      4.6487164E+06         -1.39895017890E-05      
  4      1.3112646E+06         -3.68871232742E-05      
  5      4.2618586E+05         -9.67571833585E-05      
  6      1.5323706E+05         -2.49976984695E-04      
  7      5.9459404E+04         -6.41761654033E-04      
  8      2.4492812E+04         -1.61890868484E-03      
  9      1.0590253E+04         -3.99831212482E-03      
 10      4.7697841E+03         -9.53884229736E-03      
 11      2.2263698E+03         -2.17583585211E-02      
 12      1.0730862E+03         -4.62451430935E-02      
 13      5.3250059E+02         -8.89682567614E-02      
 14      2.7129755E+02         -1.44190997946E-01      
 15      1.4131195E+02         -1.70009544968E-01      
 16      7.4584433E+01         -5.91216839489E-02      
 17      3.8298338E+01          2.66583913208E-01      
 18      2.0469130E+01          5.21940553616E-01      
 19      1.0939578E+01          3.27305217586E-01      
 20      5.5903670E+00          5.68048396555E-02      
 21      2.8828590E+00          1.81600495032E-03      
 22      1.4660860E+00          1.28510333499E-03      
S   22
  1      1.3750753E+08          6.44028505917E-07      
  2      2.0515052E+07          1.90726003366E-06      
  3      4.6487164E+06          5.46963871502E-06      
  4      1.3112646E+06          1.44247057710E-05      
  5      4.2618586E+05          3.78551320724E-05      
  6      1.5323706E+05          9.78082137152E-05      
  7      5.9459404E+04          2.51281257838E-04      
  8      2.4492812E+04          6.33939047044E-04      
  9      1.0590253E+04          1.56799578013E-03      
 10      4.7697841E+03          3.74514151973E-03      
 11      2.2263698E+03          8.58082731789E-03      
 12      1.0730862E+03          1.83513155556E-02      
 13      5.3250059E+02          3.58452665942E-02      
 14      2.7129755E+02          5.95538729138E-02      
 15      1.4131195E+02          7.36194041375E-02      
 16      7.4584433E+01          2.64165011220E-02      
 17      3.8298338E+01         -1.47973171302E-01      
 18      2.0469130E+01         -3.96613273501E-01      
 19      1.0939578E+01         -3.25137491813E-01      
 20      5.5903670E+00          2.25519437830E-01      
 21      2.8828590E+00          6.47959869018E-01      
 22      1.4660860E+00          3.99736200617E-01      
S   22
  1      1.3750753E+08         -1.78812344005E-07      
  2      2.0515052E+07         -5.29537807343E-07      
  3      4.6487164E+06         -1.51874888506E-06      
  4      1.3112646E+06         -4.00505368037E-06      
  5      4.2618586E+05         -1.05126716748E-05      
  6      1.5323706E+05         -2.71572517923E-05      
  7      5.9459404E+04         -6.97955239315E-05      
  8      2.4492812E+04         -1.76025471335E-04      
  9      1.0590253E+04         -4.35657017059E-04      
 10      4.7697841E+03         -1.04021400128E-03      
 11      2.2263698E+03         -2.38628674816E-03      
 12      1.0730862E+03         -5.10419533856E-03      
 13      5.3250059E+02         -1.00011001589E-02      
 14      2.7129755E+02         -1.66540040271E-02      
 15      1.4131195E+02         -2.07735491896E-02      
 16      7.4584433E+01         -7.43384412511E-03      
 17      3.8298338E+01          4.30998955199E-02      
 18      2.0469130E+01          1.22095809057E-01      
 19      1.0939578E+01          1.02574935414E-01      
 20      5.5903670E+00         -8.41281460091E-02      
 21      2.8828590E+00         -2.82816001670E-01      
 22      1.4660860E+00         -3.27784869181E-01      
S   1
  1      6.7483900E-01          1.0000000        
S   1
  1      3.4639900E-01          1.0000000        
S   1
  1      1.5928900E-01          1.0000000        
S   1
  1      7.2109000E-02          1.0000000        
P   13
  1      3.4166161E+04          1.21443269167E-04      
  2      8.0865608E+03          4.71886214049E-04      
  3      2.6265114E+03          2.15524004332E-03      
  4      1.0053950E+03          8.43626758015E-03      
  5      4.2712735E+02          2.87907457213E-02      
  6      1.9515113E+02          8.20075646496E-02      
  7      9.4054308E+01          1.86210981985E-01      
  8      4.6999880E+01          3.13219327370E-01      
  9      2.4117457E+01          3.41047849021E-01      
 10      1.2519982E+01          1.87364721073E-01      
 11      6.3573250E+00          3.74815098528E-02      
 12      3.1680520E+00          2.14441743699E-03      
 13      1.5534810E+00          7.13940302565E-04      
P   13
  1      3.4166161E+04         -4.76233584757E-05      
  2      8.0865608E+03         -1.85350059422E-04      
  3      2.6265114E+03         -8.49669971035E-04      
  4      1.0053950E+03         -3.34280798842E-03      
  5      4.2712735E+02         -1.15610218763E-02      
  6      1.9515113E+02         -3.37190957799E-02      
  7      9.4054308E+01         -7.96756828775E-02      
  8      4.6999880E+01         -1.40743313589E-01      
  9      2.4117457E+01         -1.58156097154E-01      
 10      1.2519982E+01         -1.25921441438E-03      
 11      6.3573250E+00          3.06010150003E-01      
 12      3.1680520E+00          4.70239428453E-01      
 13      1.5534810E+00          2.97113238412E-01      
P   13
  1      3.4166161E+04          1.05106029545E-05      
  2      8.0865608E+03          4.09174149024E-05      
  3      2.6265114E+03          1.87632998796E-04      
  4      1.0053950E+03          7.38707298493E-04      
  5      4.2712735E+02          2.55844351483E-03      
  6      1.9515113E+02          7.48359664377E-03      
  7      9.4054308E+01          1.77635488462E-02      
  8      4.6999880E+01          3.15852855796E-02      
  9      2.4117457E+01          3.56323301773E-02      
 10      1.2519982E+01         -3.34324063130E-03      
 11      6.3573250E+00         -8.29247659292E-02      
 12      3.1680520E+00         -1.33861982019E-01      
 13      1.5534810E+00         -1.00197290847E-01      
P   1
  1      7.1032500E-01          1.0000000        
P   1
  1      3.2095500E-01          1.0000000        
P   1
  1      1.3935700E-01          1.0000000        
P   1
  1      5.8410000E-02          1.0000000        
D   9
  1      1.4244506E+03          7.99091403022E-05      
  2      4.3106676E+02          6.97131980456E-04      
  3      1.6812864E+02          4.01593391765E-03      
  4      7.4866724E+01          1.65209822296E-02      
  5      3.5945855E+01          5.05472337155E-02      
  6      1.8098474E+01          1.20543134187E-01      
  7      9.4057800E+00          2.15649485248E-01      
  8      4.9239040E+00          2.87550183440E-01      
  9      2.5564930E+00          2.94556610379E-01      
D   1
  1      1.3042330E+00          1.0000000        
D   1
  1      6.3711800E-01          1.0000000        
D   1
  1      2.7579500E-01          1.0000000        
D   1
  1      1.1530000E-01          1.0000000        
F   1
  1      7.5990000E-01          1.0000000        
F   1
  1      3.8590000E-01          1.0000000        
F   1
  1      1.9600000E-01          1.0000000        
G   1
  1      8.0920000E-01          1.0000000        
G   1
  1      3.7000000E-01          1.0000000        
H   1
  1      6.7730000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Se
data:
SELENIUM
S   22
  1      1.5443225E+08          5.28344523676E-06      
  2      2.3129212E+07          1.54204527309E-05      
  3      5.2617929E+06          4.35503102595E-05      
  4      1.4888167E+06          1.12824800818E-04      
  5      4.8465656E+05          2.91113798998E-04      
  6      1.7427063E+05          7.41634072071E-04      
  7      6.7529090E+04          1.88269193830E-03      
  8      2.7750837E+04          4.71035806264E-03      
  9      1.1964216E+04          1.15222163356E-02      
 10      5.3707148E+03          2.71710234823E-02      
 11      2.4973194E+03          6.05031454194E-02      
 12      1.1987679E+03          1.22927106442E-01      
 13      5.9258026E+02          2.15260796976E-01      
 14      3.0097708E+02          2.94824378726E-01      
 15      1.5646024E+02          2.66960296873E-01      
 16      8.2476086E+01          1.22553381945E-01      
 17      4.2270887E+01          1.73155715806E-02      
 18      2.2630220E+01          8.34088797030E-05      
 19      1.2122374E+01          3.07268648780E-04      
 20      6.2491700E+00         -1.60866830191E-04      
 21      3.2426780E+00          2.96230930130E-05      
 22      1.6663620E+00         -3.62431180118E-05      
S   22
  1      1.5443225E+08         -1.69863798472E-06      
  2      2.3129212E+07         -4.96375787619E-06      
  3      5.2617929E+06         -1.40438983174E-05      
  4      1.4888167E+06         -3.64622379315E-05      
  5      4.8465656E+05         -9.43423677842E-05      
  6      1.7427063E+05         -2.40924557946E-04      
  7      6.7529090E+04         -6.13754785749E-04      
  8      2.7750837E+04         -1.54107243433E-03      
  9      1.1964216E+04         -3.79921281471E-03      
 10      5.3707148E+03         -9.07351609408E-03      
 11      2.4973194E+03         -2.07798580321E-02      
 12      1.1987679E+03         -4.44497095653E-02      
 13      5.9258026E+02         -8.62587017798E-02      
 14      3.0097708E+02         -1.41615270923E-01      
 15      1.5646024E+02         -1.71556264671E-01      
 16      8.2476086E+01         -7.08393505327E-02      
 17      4.2270887E+01          2.46980689223E-01      
 18      2.2630220E+01          5.18562337533E-01      
 19      1.2122374E+01          3.44641910978E-01      
 20      6.2491700E+00          6.51597464826E-02      
 21      3.2426780E+00          2.26064450150E-03      
 22      1.6663620E+00          1.37386694387E-03      
S   22
  1      1.5443225E+08          6.70701310908E-07      
  2      2.3129212E+07          1.96017309660E-06      
  3      5.2617929E+06          5.54743561094E-06      
  4      1.4888167E+06          1.44056703713E-05      
  5      4.8465656E+05          3.72909060014E-05      
  6      1.7427063E+05          9.52430386611E-05      
  7      6.7529090E+04          2.42798382280E-04      
  8      2.7750837E+04          6.09731188824E-04      
  9      1.1964216E+04          1.50526336709E-03      
 10      5.3707148E+03          3.59921603661E-03      
 11      2.4973194E+03          8.27756515228E-03      
 12      1.1987679E+03          1.78146512569E-02      
 13      5.9258026E+02          3.50787006216E-02      
 14      3.0097708E+02          5.90055580874E-02      
 15      1.5646024E+02          7.48528078782E-02      
 16      8.2476086E+01          3.21250081658E-02      
 17      4.2270887E+01         -1.37780033850E-01      
 18      2.2630220E+01         -3.91804310217E-01      
 19      1.2122374E+01         -3.46108176853E-01      
 20      6.2491700E+00          1.91632382401E-01      
 21      3.2426780E+00          6.49004840566E-01      
 22      1.6663620E+00          4.22752426360E-01      
S   22
  1      1.5443225E+08         -1.96987932388E-07      
  2      2.3129212E+07         -5.75703961663E-07      
  3      5.2617929E+06         -1.62944215015E-06      
  4      1.4888167E+06         -4.23110360108E-06      
  5      4.8465656E+05         -1.09550449778E-05      
  6      1.7427063E+05         -2.79746588116E-05      
  7      6.7529090E+04         -7.13413420140E-05      
  8      2.7750837E+04         -1.79097238675E-04      
  9      1.1964216E+04         -4.42429189414E-04      
 10      5.3707148E+03         -1.05750775445E-03      
 11      2.4973194E+03         -2.43515920313E-03      
 12      1.1987679E+03         -5.24149668923E-03      
 13      5.9258026E+02         -1.03536332960E-02      
 14      3.0097708E+02         -1.74550508431E-02      
 15      1.5646024E+02         -2.23463888287E-02      
 16      8.2476086E+01         -9.58104592157E-03      
 17      4.2270887E+01          4.24538765274E-02      
 18      2.2630220E+01          1.27747495068E-01      
 19      1.2122374E+01          1.16069920824E-01      
 20      6.2491700E+00         -7.58623088583E-02      
 21      3.2426780E+00         -3.01162159632E-01      
 22      1.6663620E+00         -3.62595940363E-01      
S   1
  1      7.8726400E-01          1.0000000        
S   1
  1      4.0297200E-01          1.0000000        
S   1
  1      1.8709600E-01          1.0000000        
S   1
  1      8.4706000E-02          1.0000000        
P   13
  1      3.6511337E+04          1.27230043965E-04      
  2      8.6405510E+03          4.82683097485E-04      
  3      2.8056911E+03          2.18109985734E-03      
  4      1.0734961E+03          8.48823653571E-03      
  5      4.5577475E+02          2.89367931373E-02      
  6      2.0809432E+02          8.24392248530E-02      
  7      1.0023111E+02          1.87258861777E-01      
  8      5.0073522E+01          3.14569395670E-01      
  9      2.5700262E+01          3.40586450955E-01      
 10      1.3346792E+01          1.85287121202E-01      
 11      6.7870510E+00          3.66176191726E-02      
 12      3.3916540E+00          2.07626288991E-03      
 13      1.6703270E+00          6.52924812362E-04      
P   13
  1      3.6511337E+04         -5.06148750160E-05      
  2      8.6405510E+03         -1.92380631661E-04      
  3      2.8056911E+03         -8.72409404497E-04      
  4      1.0734961E+03         -3.41352933544E-03      
  5      4.5577475E+02         -1.17915353149E-02      
  6      2.0809432E+02         -3.44153557928E-02      
  7      1.0023111E+02         -8.13597795764E-02      
  8      5.0073522E+01         -1.43705174219E-01      
  9      2.5700262E+01         -1.59893233121E-01      
 10      1.3346792E+01          2.72170032525E-03      
 11      6.7870510E+00          3.14751742993E-01      
 12      3.3916540E+00          4.75778690080E-01      
 13      1.6703270E+00          2.86322049435E-01      
P   13
  1      3.6511337E+04          1.22109729320E-05      
  2      8.6405510E+03          4.63777612483E-05      
  3      2.8056911E+03          2.10717047850E-04      
  4      1.0734961E+03          8.23608007837E-04      
  5      4.5577475E+02          2.85499274539E-03      
  6      2.0809432E+02          8.34041749477E-03      
  7      1.0023111E+02          1.98629433005E-02      
  8      5.0073522E+01          3.52118110077E-02      
  9      2.5700262E+01          3.95690901567E-02      
 10      1.3346792E+01         -5.43767249947E-03      
 11      6.7870510E+00         -9.34046480731E-02      
 12      3.3916540E+00         -1.53369610734E-01      
 13      1.6703270E+00         -1.01010700093E-01      
P   1
  1      7.5259900E-01          1.0000000        
P   1
  1      3.4681300E-01          1.0000000        
P   1
  1      1.5185500E-01          1.0000000        
P   1
  1      6.3856000E-02          1.0000000        
D   9
  1      1.6350663E+03          7.25558700068E-05      
  2      4.9467266E+02          6.28640009822E-04      
  3      1.9284388E+02          3.64476534202E-03      
  4      8.5782195E+01          1.52737412109E-02      
  5      4.1149966E+01          4.78308086821E-02      
  6      2.0678170E+01          1.16944999512E-01      
  7      1.0726386E+01          2.14752341714E-01      
  8      5.6124540E+00          2.91657604701E-01      
  9      2.9203760E+00          2.99813781925E-01      
D   1
  1      1.4981840E+00          1.0000000        
D   1
  1      7.3599900E-01          1.0000000        
D   1
  1      3.1600400E-01          1.0000000        
D   1
  1      1.3310000E-01          1.0000000        
F   1
  1      8.4420000E-01          1.0000000        
F   1
  1      4.2110000E-01          1.0000000        
F   1
  1      2.1000000E-01          1.0000000        
G   1
  1      8.6590000E-01          1.0000000        
G   1
  1      3.8500000E-01          1.0000000        
H   1
  1      7.2350000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Br
data:
BROMINE
S   22
  1      1.6573515E+08          5.60557686207E-06      
  2      2.4774379E+07          1.62960925147E-05      
  3      5.6282020E+06          4.57089061738E-05      
  4      1.5918997E+06          1.17327362213E-04      
  5      5.1826380E+05          2.99692943040E-04      
  6      1.8649092E+05          7.55563946114E-04      
  7      7.2332493E+04          1.90068355186E-03      
  8      2.9761135E+04          4.71606671025E-03      
  9      1.2851712E+04          1.14527447152E-02      
 10      5.7809430E+03          2.68318107502E-02      
 11      2.6950098E+03          5.94131490147E-02      
 12      1.2976604E+03          1.20258961220E-01      
 13      6.4363493E+02          2.10682940164E-01      
 14      3.2795194E+02          2.91142340704E-01      
 15      1.7092262E+02          2.69818263123E-01      
 16      9.0250141E+01          1.29510778442E-01      
 17      4.6292467E+01          1.96916504209E-02      
 18      2.4848661E+01         -1.20231919776E-05      
 19      1.3347137E+01          4.10082189883E-04      
 20      6.9482580E+00         -2.14497029805E-04      
 21      3.6250750E+00          5.90688056727E-05      
 22      1.8821530E+00         -5.45874162330E-05      
S   22
  1      1.6573515E+08         -1.81030277448E-06      
  2      2.4774379E+07         -5.26925454034E-06      
  3      5.6282020E+06         -1.48068539762E-05      
  4      1.5918997E+06         -3.80923394383E-05      
  5      5.1826380E+05         -9.75816351546E-05      
  6      1.8649092E+05         -2.46647511573E-04      
  7      7.2332493E+04         -6.22730449838E-04      
  8      2.9761135E+04         -1.55085881034E-03      
  9      1.2851712E+04         -3.79581019590E-03      
 10      5.7809430E+03         -9.00527344492E-03      
 11      2.6950098E+03         -2.04990722476E-02      
 12      1.2976604E+03         -4.36324738659E-02      
 13      6.4363493E+02         -8.44922903226E-02      
 14      3.2795194E+02         -1.39222232753E-01      
 15      1.7092262E+02         -1.71592122986E-01      
 16      9.0250141E+01         -7.91021107758E-02      
 17      4.6292467E+01          2.30380298423E-01      
 18      2.4848661E+01          5.13937011310E-01      
 19      1.3347137E+01          3.58949912477E-01      
 20      6.9482580E+00          7.32074702437E-02      
 21      3.6250750E+00          2.98414755608E-03      
 22      1.8821530E+00          1.36500752039E-03      
S   22
  1      1.6573515E+08          7.21916809896E-07      
  2      2.4774379E+07          2.10157179437E-06      
  3      5.6282020E+06          5.90713748696E-06      
  4      1.5918997E+06          1.52002138057E-05      
  5      5.1826380E+05          3.89568023206E-05      
  6      1.8649092E+05          9.84855000139E-05      
  7      7.2332493E+04          2.48819487893E-04      
  8      2.9761135E+04          6.19802432896E-04      
  9      1.2851712E+04          1.51902790295E-03      
 10      5.7809430E+03          3.60831612754E-03      
 11      2.6950098E+03          8.24746633027E-03      
 12      1.2976604E+03          1.76624557756E-02      
 13      6.4363493E+02          3.46924940789E-02      
 14      3.2795194E+02          5.85485479626E-02      
 15      1.7092262E+02          7.54859352058E-02      
 16      9.0250141E+01          3.62973247347E-02      
 17      4.6292467E+01         -1.29413111063E-01      
 18      2.4848661E+01         -3.87182651181E-01      
 19      1.3347137E+01         -3.63544179619E-01      
 20      6.9482580E+00          1.60699079433E-01      
 21      3.6250750E+00          6.47879567212E-01      
 22      1.8821530E+00          4.43589301828E-01      
S   22
  1      1.6573515E+08         -2.21920552083E-07      
  2      2.4774379E+07         -6.46024705085E-07      
  3      5.6282020E+06         -1.81603917384E-06      
  4      1.5918997E+06         -4.67274295186E-06      
  5      5.1826380E+05         -1.19784263079E-05      
  6      1.8649092E+05         -3.02766983339E-05      
  7      7.2332493E+04         -7.65228815550E-05      
  8      2.9761135E+04         -1.90550552205E-04      
  9      1.2851712E+04         -4.67322500810E-04      
 10      5.7809430E+03         -1.10965586463E-03      
 11      2.6950098E+03         -2.53967833436E-03      
 12      1.2976604E+03         -5.43929919059E-03      
 13      6.4363493E+02         -1.07187744673E-02      
 14      3.2795194E+02         -1.81289429546E-02      
 15      1.7092262E+02         -2.35933798706E-02      
 16      9.0250141E+01         -1.13416911637E-02      
 17      4.6292467E+01          4.17448194710E-02      
 18      2.4848661E+01          1.32302071450E-01      
 19      1.3347137E+01          1.28121686426E-01      
 20      6.9482580E+00         -6.67548603616E-02      
 21      3.6250750E+00         -3.16127594765E-01      
 22      1.8821530E+00         -3.93782544998E-01      
S   1
  1      9.1082200E-01          1.0000000        
S   1
  1      4.6395700E-01          1.0000000        
S   1
  1      2.1693300E-01          1.0000000        
S   1
  1      9.8406000E-02          1.0000000        
P   13
  1      3.9391530E+04          1.31626673885E-04      
  2      9.3252225E+03          4.85523214682E-04      
  3      3.0289943E+03          2.16480451864E-03      
  4      1.1595145E+03          8.35271465540E-03      
  5      4.9268131E+02          2.83853303555E-02      
  6      2.2517451E+02          8.08360036994E-02      
  7      1.0859326E+02          1.84206898038E-01      
  8      5.4336079E+01          3.11546111588E-01      
  9      2.7936650E+01          3.41495145377E-01      
 10      1.4539626E+01          1.89895048809E-01      
 11      7.4213070E+00          3.89109310136E-02      
 12      3.7303890E+00          2.19092011082E-03      
 13      1.8541270E+00          6.65096646576E-04      
P   13
  1      3.9391530E+04         -5.30880539069E-05      
  2      9.3252225E+03         -1.96220271843E-04      
  3      3.0289943E+03         -8.77957868423E-04      
  4      1.1595145E+03         -3.40626927767E-03      
  5      4.9268131E+02         -1.17272672465E-02      
  6      2.2517451E+02         -3.42127594117E-02      
  7      1.0859326E+02         -8.11262403893E-02      
  8      5.4336079E+01         -1.44311617050E-01      
  9      2.7936650E+01         -1.62779528501E-01      
 10      1.4539626E+01         -3.08882113431E-03      
 11      7.4213070E+00          3.11193565100E-01      
 12      3.7303890E+00          4.79421361623E-01      
 13      1.8541270E+00          2.87313376438E-01      
P   13
  1      3.9391530E+04          1.37195057753E-05      
  2      9.3252225E+03          5.06588201189E-05      
  3      3.0289943E+03          2.27204814487E-04      
  4      1.1595145E+03          8.80122715909E-04      
  5      4.9268131E+02          3.04276576844E-03      
  6      2.2517451E+02          8.88027544946E-03      
  7      1.0859326E+02          2.12341936860E-02      
  8      5.4336079E+01          3.78840614876E-02      
  9      2.7936650E+01          4.32626593536E-02      
 10      1.4539626E+01         -4.51378003917E-03      
 11      7.4213070E+00         -9.96481752089E-02      
 12      3.7303890E+00         -1.68938216035E-01      
 13      1.8541270E+00         -1.06624266322E-01      
P   1
  1      8.4533700E-01          1.0000000        
P   1
  1      3.9215200E-01          1.0000000        
P   1
  1      1.7276700E-01          1.0000000        
P   1
  1      7.2908000E-02          1.0000000        
D   9
  1      1.8506354E+03          6.75698694903E-05      
  2      5.5707125E+02          5.86856575021E-04      
  3      2.1648687E+02          3.42902630368E-03      
  4      9.6138850E+01          1.45464211455E-02      
  5      4.6126380E+01          4.61601714308E-02      
  6      2.3201164E+01          1.14367664154E-01      
  7      1.2055926E+01          2.13407187240E-01      
  8      6.3255450E+00          2.94007335762E-01      
  9      3.3049220E+00          3.03761732629E-01      
D   1
  1      1.7042530E+00          1.0000000        
D   1
  1      8.3994000E-01          1.0000000        
D   1
  1      3.5695300E-01          1.0000000        
D   1
  1      1.5200000E-01          1.0000000        
F   1
  1      9.6270000E-01          1.0000000        
F   1
  1      4.9550000E-01          1.0000000        
F   1
  1      2.5500000E-01          1.0000000        
G   1
  1      9.7680000E-01          1.0000000        
G   1
  1      4.3900000E-01          1.0000000        
H   1
  1      8.1930000E-01          1.0000000        


name: cc-pV5Z(pt/sf/lc)
description: V5Z4P Relativistic Valence Quintuple Zeta + Polarization
elt: Kr
data:
KRYPTON
S   22
  1      1.8282209E+08          5.80889979986E-06      
  2      2.7356156E+07          1.67471636007E-05      
  3      6.2211704E+06          4.65643267572E-05      
  4      1.7602779E+06          1.18221761847E-04      
  5      5.7319382E+05          2.98568454316E-04      
  6      2.0625845E+05          7.44228777645E-04      
  7      8.0026669E+04          1.85280699515E-03      
  8      3.2939084E+04          4.56118094586E-03      
  9      1.4222633E+04          1.10235039054E-02      
 10      6.3930707E+03          2.57795959433E-02      
 11      2.9764538E+03          5.71634847001E-02      
 12      1.4305254E+03          1.16297964001E-01      
 13      7.0792621E+02          2.05725236039E-01      
 14      3.5984847E+02          2.88816177088E-01      
 15      1.8714965E+02          2.74582434918E-01      
 16      9.8634523E+01          1.37237310222E-01      
 17      5.0547869E+01          2.21873714866E-02      
 18      2.7167004E+01         -7.62172200650E-05      
 19      1.4615098E+01          4.99426459175E-04      
 20      7.6513520E+00         -2.60787977797E-04      
 21      3.9972630E+00          8.37183575651E-05      
 22      2.0858530E+00         -6.97643826944E-05      
S   22
  1      1.8282209E+08         -1.88417808479E-06      
  2      2.7356156E+07         -5.43876582915E-06      
  3      6.2211704E+06         -1.51499357143E-05      
  4      1.7602779E+06         -3.85525074556E-05      
  5      5.7319382E+05         -9.76544681618E-05      
  6      2.0625845E+05         -2.44078104767E-04      
  7      8.0026669E+04         -6.09942179336E-04      
  8      3.2939084E+04         -1.50716113918E-03      
  9      1.4222633E+04         -3.67073114784E-03      
 10      6.3930707E+03         -8.68914168438E-03      
 11      2.9764538E+03         -1.97880849302E-02      
 12      1.4305254E+03         -4.22569624787E-02      
 13      7.0792621E+02         -8.23472296551E-02      
 14      3.5984847E+02         -1.37113963616E-01      
 15      1.8714965E+02         -1.72454404370E-01      
 16      9.8634523E+01         -8.75618264354E-02      
 17      5.0547869E+01          2.15083543989E-01      
 18      2.7167004E+01          5.09591725934E-01      
 19      1.4615098E+01          3.71898826442E-01      
 20      7.6513520E+00          8.07215107533E-02      
 21      3.9972630E+00          3.54890220623E-03      
 22      2.0858530E+00          1.37712493660E-03      
S   22
  1      1.8282209E+08          7.58561177049E-07      
  2      2.7356156E+07          2.18993437464E-06      
  3      6.2211704E+06          6.10178538935E-06      
  4      1.7602779E+06          1.55313290339E-05      
  5      5.7319382E+05          3.93590884259E-05      
  6      2.0625845E+05          9.83987271233E-05      
  7      8.0026669E+04          2.46048890898E-04      
  8      3.2939084E+04          6.08170947642E-04      
  9      1.4222633E+04          1.48305077023E-03      
 10      6.3930707E+03          3.51525901321E-03      
 11      2.9764538E+03          8.03642331966E-03      
 12      1.4305254E+03          1.72664802707E-02      
 13      7.0792621E+02          3.41105749593E-02      
 14      3.5984847E+02          5.81545359849E-02      
 15      1.8714965E+02          7.64258242601E-02      
 16      9.8634523E+01          4.06175450465E-02      
 17      5.0547869E+01         -1.21716611161E-01      
 18      2.7167004E+01         -3.83224935778E-01      
 19      1.4615098E+01         -3.79196594924E-01      
 20      7.6513520E+00          1.36941965667E-01      
 21      3.9972630E+00          6.52033455337E-01      
 22      2.0858530E+00          4.56880180098E-01      
S   22
  1      1.8282209E+08         -2.42198547151E-07      
  2      2.7356156E+07         -6.99200170743E-07      
  3      6.2211704E+06         -1.94840919108E-06      
  4      1.7602779E+06         -4.95898374588E-06      
  5      5.7319382E+05         -1.25703491907E-05      
  6      2.0625845E+05         -3.14181377118E-05      
  7      8.0026669E+04         -7.86016443594E-05      
  8      3.2939084E+04         -1.94189585494E-04      
  9      1.4222633E+04         -4.73946244597E-04      
 10      6.3930707E+03         -1.12271350838E-03      
 11      2.9764538E+03         -2.57076315005E-03      
 12      1.4305254E+03         -5.52203446864E-03      
 13      7.0792621E+02         -1.09489746630E-02      
 14      3.5984847E+02         -1.86977982362E-02      
 15      1.8714965E+02         -2.48256870099E-02      
 16      9.8634523E+01         -1.31692603772E-02      
 17      5.0547869E+01          4.07301659848E-02      
 18      2.7167004E+01          1.36296309598E-01      
 19      1.4615098E+01          1.39041651046E-01      
 20      7.6513520E+00         -5.86634391110E-02      
 21      3.9972630E+00         -3.34505045106E-01      
 22      2.0858530E+00         -4.20210533200E-01      
S   1
  1      1.0147970E+00          1.0000000        
S   1
  1      5.1978800E-01          1.0000000        
S   1
  1      2.4510300E-01          1.0000000        
S   1
  1      1.1189600E-01          1.0000000        
P   13
  1      4.2993056E+04          1.34311042906E-04      
  2      1.0173723E+04          4.80607883224E-04      
  3      3.3031057E+03          2.11344291351E-03      
  4      1.2635400E+03          8.09999625355E-03      
  5      5.3636546E+02          2.75418378566E-02      
  6      2.4487617E+02          7.87513104698E-02      
  7      1.1799117E+02          1.80764464884E-01      
  8      5.9021248E+01          3.08653608583E-01      
  9      3.0356067E+01          3.42987887270E-01      
 10      1.5819977E+01          1.94917384704E-01      
 11      8.1045800E+00          4.13832975439E-02      
 12      4.0979640E+00          2.33924063237E-03      
 13      2.0560610E+00          6.73098147503E-04      
P   13
  1      4.2993056E+04         -5.49020684329E-05      
  2      1.0173723E+04         -1.96885847339E-04      
  3      3.3031057E+03         -8.68759449783E-04      
  4      1.2635400E+03         -3.34832641661E-03      
  5      5.3636546E+02         -1.15307743313E-02      
  6      2.4487617E+02         -3.37710593283E-02      
  7      1.1799117E+02         -8.06430527304E-02      
  8      5.9021248E+01         -1.44879823816E-01      
  9      3.0356067E+01         -1.65965676698E-01      
 10      1.5819977E+01         -9.45566719920E-03      
 11      8.1045800E+00          3.06972612047E-01      
 12      4.0979640E+00          4.82698682889E-01      
 13      2.0560610E+00          2.89266491674E-01      
P   13
  1      4.2993056E+04          1.49034093463E-05      
  2      1.0173723E+04          5.33880137431E-05      
  3      3.3031057E+03          2.36188991251E-04      
  4      1.2635400E+03          9.08675953635E-04      
  5      5.3636546E+02          3.14340290354E-03      
  6      2.4487617E+02          9.20800704945E-03      
  7      1.1799117E+02          2.21863239488E-02      
  8      5.9021248E+01          3.99726485076E-02      
  9      3.0356067E+01          4.64269131352E-02      
 10      1.5819977E+01         -3.12488357309E-03      
 11      8.1045800E+00         -1.04188243195E-01      
 12      4.0979640E+00         -1.81952212519E-01      
 13      2.0560610E+00         -1.11476769063E-01      
P   1
  1      9.5214500E-01          1.0000000        
P   1
  1      4.4477400E-01          1.0000000        
P   1
  1      1.9749600E-01          1.0000000        
P   1
  1      8.3823000E-02          1.0000000        
D   9
  1      2.0674360E+03          6.37616539818E-05      
  2      6.2569371E+02          5.42301688134E-04      
  3      2.4394679E+02          3.16075510613E-03      
  4      1.0842373E+02          1.35659834102E-02      
  5      5.2005216E+01          4.38936136594E-02      
  6      2.6115405E+01          1.11100936568E-01      
  7      1.3546748E+01          2.11943594788E-01      
  8      7.1058100E+00          2.96576598774E-01      
  9      3.7215540E+00          3.07571236164E-01      
D   1
  1      1.9291200E+00          1.0000000        
D   1
  1      9.5582600E-01          1.0000000        
D   1
  1      4.0519700E-01          1.0000000        
D   1
  1      1.7410000E-01          1.0000000        
F   1
  1      1.0940000E+00          1.0000000        
F   1
  1      5.8700000E-01          1.0000000        
F   1
  1      3.1500000E-01          1.0000000        
G   1
  1      1.1040000E+00          1.0000000        
G   1
  1      5.0100000E-01          1.0000000        
H   1
  1      9.3030000E-01          1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Sc
data:
SCANDIUM
S   1
  1    228.5930000              1.0000000        
S   1
  1    105.6560000              1.0000000        
S   1
  1     52.1820000              1.0000000        
S   1
  1     22.6151000              1.0000000        
S   1
  1      8.1851300              1.0000000        
S   1
  1      2.7557900              1.0000000        
S   1
  1      1.6842100              1.0000000        
S   1
  1      1.0342000              1.0000000        
S   1
  1      0.5652380              1.0000000        
S   1
  1      0.2622400              1.0000000        
S   1
  1      0.1529780              1.0000000        
S   1
  1      0.0844840              1.0000000        
S   1
  1      0.0472720              1.0000000        
P   1
  1     89.5102000              1.0000000        
P   1
  1     38.2945000              1.0000000        
P   1
  1     16.7646000              1.0000000        
P   1
  1      7.5632100              1.0000000        
P   1
  1      2.5916300              1.0000000        
P   1
  1      1.4429200              1.0000000        
P   1
  1      1.0418700              1.0000000        
P   1
  1      0.6993540              1.0000000        
P   1
  1      0.3389220              1.0000000        
P   1
  1      0.1755120              1.0000000        
P   1
  1      0.0968660              1.0000000        
P   1
  1      0.0500370              1.0000000        
D   1
  1     30.1125000              1.0000000        
D   1
  1     14.0774000              1.0000000        
D   1
  1      5.7922400              1.0000000        
D   1
  1      2.4811100              1.0000000        
D   1
  1      1.6445800              1.0000000        
D   1
  1      0.7354520              1.0000000        
D   1
  1      0.4355810              1.0000000        
D   1
  1      0.2247210              1.0000000        
D   1
  1      0.1322840              1.0000000        
D   1
  1      0.0822010              1.0000000        
D   1
  1      0.0402500              1.0000000        
F   1
  1     25.3434000              1.0000000        
F   1
  1     11.6946000              1.0000000        
F   1
  1      5.4440000              1.0000000        
F   1
  1      3.2862100              1.0000000        
F   1
  1      1.5018800              1.0000000        
F   1
  1      0.9801550              1.0000000        
F   1
  1      0.4249380              1.0000000        
F   1
  1      0.2828750              1.0000000        
F   1
  1      0.1236490              1.0000000        
F   1
  1      0.0644760              1.0000000        
G   1
  1     15.6655000              1.0000000        
G   1
  1      6.4122700              1.0000000        
G   1
  1      3.0397200              1.0000000        
G   1
  1      1.9018000              1.0000000        
G   1
  1      0.8199130              1.0000000        
G   1
  1      0.5350670              1.0000000        
G   1
  1      0.2266020              1.0000000        
G   1
  1      0.1170540              1.0000000        
G   1
  1      0.0642340              1.0000000        
H   1
  1      8.4046100              1.0000000        
H   1
  1      3.4889000              1.0000000        
H   1
  1      1.4124000              1.0000000        
H   1
  1      0.7230170              1.0000000        
H   1
  1      0.4023960              1.0000000        
H   1
  1      0.1647560              1.0000000        
I   1
  1      6.6768200              1.0000000        
I   1
  1      2.6880000              1.0000000        
I   1
  1      1.0378700              1.0000000        
I   1
  1      0.6330330              1.0000000        
I   1
  1      0.2856600              1.0000000        
K   1
  1      4.5106000              1.0000000        
K   1
  1      2.0090200              1.0000000        
K   1
  1      1.3020100              1.0000000        
K   1
  1      0.5109810              1.0000000        
L   1
  1      1.7649100              1.0000000        
L   1
  1      0.8174360              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Ti
data:
TITANIUM
S   1
  1    245.7080000              1.0000000        
S   1
  1    119.8290000              1.0000000        
S   1
  1     57.5570000              1.0000000        
S   1
  1     24.3454000              1.0000000        
S   1
  1      9.3231600              1.0000000        
S   1
  1      3.1003500              1.0000000        
S   1
  1      1.7649400              1.0000000        
S   1
  1      0.8783330              1.0000000        
S   1
  1      0.5155950              1.0000000        
S   1
  1      0.2695470              1.0000000        
S   1
  1      0.1422140              1.0000000        
S   1
  1      0.0756380              1.0000000        
S   1
  1      0.0443810              1.0000000        
P   1
  1     93.6120000              1.0000000        
P   1
  1     43.5094000              1.0000000        
P   1
  1     18.8788000              1.0000000        
P   1
  1      7.8155300              1.0000000        
P   1
  1      2.7571700              1.0000000        
P   1
  1      1.5039100              1.0000000        
P   1
  1      0.9222230              1.0000000        
P   1
  1      0.6661050              1.0000000        
P   1
  1      0.3942750              1.0000000        
P   1
  1      0.2025560              1.0000000        
P   1
  1      0.1131190              1.0000000        
P   1
  1      0.0544830              1.0000000        
D   1
  1     31.3895000              1.0000000        
D   1
  1     14.4215000              1.0000000        
D   1
  1      5.9473500              1.0000000        
D   1
  1      2.6083900              1.0000000        
D   1
  1      1.8612800              1.0000000        
D   1
  1      0.7957810              1.0000000        
D   1
  1      0.4129310              1.0000000        
D   1
  1      0.2424610              1.0000000        
D   1
  1      0.1255810              1.0000000        
D   1
  1      0.0652700              1.0000000        
D   1
  1      0.0276990              1.0000000        
F   1
  1     27.3085000              1.0000000        
F   1
  1     11.8592000              1.0000000        
F   1
  1      5.5023700              1.0000000        
F   1
  1      3.4998900              1.0000000        
F   1
  1      1.7525700              1.0000000        
F   1
  1      1.0479900              1.0000000        
F   1
  1      0.5148330              1.0000000        
F   1
  1      0.2783490              1.0000000        
F   1
  1      0.1627010              1.0000000        
F   1
  1      0.0845540              1.0000000        
G   1
  1     16.6899000              1.0000000        
G   1
  1      6.5975900              1.0000000        
G   1
  1      3.2963100              1.0000000        
G   1
  1      1.9962800              1.0000000        
G   1
  1      1.0361200              1.0000000        
G   1
  1      0.5905930              1.0000000        
G   1
  1      0.3120720              1.0000000        
G   1
  1      0.1447340              1.0000000        
G   1
  1      0.0929420              1.0000000        
H   1
  1      9.0591700              1.0000000        
H   1
  1      4.8383700              1.0000000        
H   1
  1      2.1668800              1.0000000        
H   1
  1      1.1445900              1.0000000        
H   1
  1      0.6253810              1.0000000        
H   1
  1      0.2583160              1.0000000        
I   1
  1      7.1498700              1.0000000        
I   1
  1      3.7016600              1.0000000        
I   1
  1      1.8009700              1.0000000        
I   1
  1      1.1142000              1.0000000        
I   1
  1      0.4423240              1.0000000        
K   1
  1      4.6411100              1.0000000        
K   1
  1      2.5577300              1.0000000        
K   1
  1      1.3864500              1.0000000        
K   1
  1      0.7430420              1.0000000        
L   1
  1      2.7794500              1.0000000        
L   1
  1      1.4069300              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: V
data:
VANADIUM
S   1
  1    294.8300000              1.0000000        
S   1
  1    152.4960000              1.0000000        
S   1
  1     68.3160000              1.0000000        
S   1
  1     27.9552000              1.0000000        
S   1
  1     10.7223000              1.0000000        
S   1
  1      4.6113400              1.0000000        
S   1
  1      2.4806700              1.0000000        
S   1
  1      1.2982500              1.0000000        
S   1
  1      0.6571330              1.0000000        
S   1
  1      0.3741100              1.0000000        
S   1
  1      0.1849600              1.0000000        
S   1
  1      0.0961190              1.0000000        
S   1
  1      0.0587170              1.0000000        
P   1
  1    119.4120000              1.0000000        
P   1
  1     53.8088000              1.0000000        
P   1
  1     20.9444000              1.0000000        
P   1
  1      9.2701600              1.0000000        
P   1
  1      3.6502800              1.0000000        
P   1
  1      1.6550800              1.0000000        
P   1
  1      0.9771660              1.0000000        
P   1
  1      0.7021280              1.0000000        
P   1
  1      0.5098420              1.0000000        
P   1
  1      0.2220960              1.0000000        
P   1
  1      0.1154290              1.0000000        
P   1
  1      0.0629740              1.0000000        
D   1
  1     32.1511000              1.0000000        
D   1
  1     15.2075000              1.0000000        
D   1
  1      7.0264300              1.0000000        
D   1
  1      4.3947000              1.0000000        
D   1
  1      2.6847600              1.0000000        
D   1
  1      1.3694300              1.0000000        
D   1
  1      0.8044410              1.0000000        
D   1
  1      0.4383160              1.0000000        
D   1
  1      0.2103520              1.0000000        
D   1
  1      0.1286580              1.0000000        
D   1
  1      0.0667280              1.0000000        
F   1
  1     37.7233000              1.0000000        
F   1
  1     12.3598000              1.0000000        
F   1
  1      6.7345300              1.0000000        
F   1
  1      3.8828000              1.0000000        
F   1
  1      2.1931800              1.0000000        
F   1
  1      1.1142600              1.0000000        
F   1
  1      0.6509980              1.0000000        
F   1
  1      0.3111540              1.0000000        
F   1
  1      0.1613310              1.0000000        
F   1
  1      0.0860890              1.0000000        
G   1
  1     24.6580000              1.0000000        
G   1
  1      9.1963100              1.0000000        
G   1
  1      5.3777900              1.0000000        
G   1
  1      3.3529700              1.0000000        
G   1
  1      2.1661100              1.0000000        
G   1
  1      1.0992700              1.0000000        
G   1
  1      0.4705120              1.0000000        
G   1
  1      0.2879430              1.0000000        
G   1
  1      0.1356520              1.0000000        
H   1
  1     12.0383000              1.0000000        
H   1
  1      6.3089000              1.0000000        
H   1
  1      2.8028500              1.0000000        
H   1
  1      1.5443100              1.0000000        
H   1
  1      0.8416840              1.0000000        
H   1
  1      0.3494730              1.0000000        
I   1
  1      8.4503400              1.0000000        
I   1
  1      4.6613100              1.0000000        
I   1
  1      1.9140400              1.0000000        
I   1
  1      0.9502380              1.0000000        
I   1
  1      0.5583180              1.0000000        
K   1
  1      8.4126200              1.0000000        
K   1
  1      3.7763400              1.0000000        
K   1
  1      2.4141200              1.0000000        
K   1
  1      1.0633700              1.0000000        
L   1
  1      4.2322700              1.0000000        
L   1
  1      2.1388100              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Cr
data:
CHROMIUM
S   1
  1    345.7490000              1.0000000        
S   1
  1    173.4600000              1.0000000        
S   1
  1     76.3031000              1.0000000        
S   1
  1     31.9512000              1.0000000        
S   1
  1     11.9227000              1.0000000        
S   1
  1      5.4082900              1.0000000        
S   1
  1      3.2655400              1.0000000        
S   1
  1      1.7980400              1.0000000        
S   1
  1      0.7273280              1.0000000        
S   1
  1      0.4928070              1.0000000        
S   1
  1      0.2462630              1.0000000        
S   1
  1      0.1400430              1.0000000        
S   1
  1      0.0713240              1.0000000        
P   1
  1    142.4390000              1.0000000        
P   1
  1     59.9406000              1.0000000        
P   1
  1     23.6255000              1.0000000        
P   1
  1     10.3934000              1.0000000        
P   1
  1      4.3221600              1.0000000        
P   1
  1      1.8586600              1.0000000        
P   1
  1      1.1959800              1.0000000        
P   1
  1      0.8228320              1.0000000        
P   1
  1      0.5636810              1.0000000        
P   1
  1      0.2538130              1.0000000        
P   1
  1      0.1313080              1.0000000        
P   1
  1      0.0669510              1.0000000        
D   1
  1     32.7139000              1.0000000        
D   1
  1     15.8415000              1.0000000        
D   1
  1      7.8138700              1.0000000        
D   1
  1      4.9436800              1.0000000        
D   1
  1      2.7326200              1.0000000        
D   1
  1      1.7733400              1.0000000        
D   1
  1      0.8089420              1.0000000        
D   1
  1      0.5466710              1.0000000        
D   1
  1      0.2208630              1.0000000        
D   1
  1      0.1556800              1.0000000        
D   1
  1      0.0777730              1.0000000        
F   1
  1     43.8090000              1.0000000        
F   1
  1     13.9163000              1.0000000        
F   1
  1      7.2145000              1.0000000        
F   1
  1      4.1983200              1.0000000        
F   1
  1      2.5598500              1.0000000        
F   1
  1      1.1717100              1.0000000        
F   1
  1      0.7417190              1.0000000        
F   1
  1      0.3385600              1.0000000        
F   1
  1      0.1779650              1.0000000        
F   1
  1      0.0865690              1.0000000        
G   1
  1     32.3600000              1.0000000        
G   1
  1     12.3382000              1.0000000        
G   1
  1      6.7983000              1.0000000        
G   1
  1      4.3248200              1.0000000        
G   1
  1      1.9822700              1.0000000        
G   1
  1      1.1777800              1.0000000        
G   1
  1      0.5355170              1.0000000        
G   1
  1      0.2953820              1.0000000        
G   1
  1      0.1502290              1.0000000        
H   1
  1     15.3952000              1.0000000        
H   1
  1      8.0761000              1.0000000        
H   1
  1      3.4385100              1.0000000        
H   1
  1      1.9790700              1.0000000        
H   1
  1      1.0535800              1.0000000        
H   1
  1      0.4305510              1.0000000        
I   1
  1     10.1607000              1.0000000        
I   1
  1      5.6370800              1.0000000        
I   1
  1      2.5652000              1.0000000        
I   1
  1      1.6414200              1.0000000        
I   1
  1      0.7274100              1.0000000        
K   1
  1     10.6125000              1.0000000        
K   1
  1      4.5840100              1.0000000        
K   1
  1      2.6706500              1.0000000        
K   1
  1      1.3073900              1.0000000        
L   1
  1      5.4194300              1.0000000        
L   1
  1      2.8851100              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Mn
data:
MANGANESE
S   1
  1    382.4970000              1.0000000        
S   1
  1    195.3480000              1.0000000        
S   1
  1     83.2642000              1.0000000        
S   1
  1     34.9383000              1.0000000        
S   1
  1     12.9203000              1.0000000        
S   1
  1      6.0208100              1.0000000        
S   1
  1      3.3670000              1.0000000        
S   1
  1      1.8517000              1.0000000        
S   1
  1      0.7197120              1.0000000        
S   1
  1      0.5395300              1.0000000        
S   1
  1      0.2311770              1.0000000        
S   1
  1      0.1485010              1.0000000        
S   1
  1      0.0753130              1.0000000        
P   1
  1    150.3640000              1.0000000        
P   1
  1     64.9717000              1.0000000        
P   1
  1     24.9382000              1.0000000        
P   1
  1     10.9290000              1.0000000        
P   1
  1      5.1832500              1.0000000        
P   1
  1      2.1282400              1.0000000        
P   1
  1      1.3154600              1.0000000        
P   1
  1      0.8738670              1.0000000        
P   1
  1      0.5936140              1.0000000        
P   1
  1      0.2759810              1.0000000        
P   1
  1      0.1347950              1.0000000        
P   1
  1      0.0694290              1.0000000        
D   1
  1     33.7152000              1.0000000        
D   1
  1     17.1150000              1.0000000        
D   1
  1      8.9306600              1.0000000        
D   1
  1      5.1600000              1.0000000        
D   1
  1      2.8184000              1.0000000        
D   1
  1      1.8037500              1.0000000        
D   1
  1      0.7237970              1.0000000        
D   1
  1      0.5447030              1.0000000        
D   1
  1      0.2376180              1.0000000        
D   1
  1      0.1599580              1.0000000        
D   1
  1      0.0822370              1.0000000        
F   1
  1     52.2649000              1.0000000        
F   1
  1     16.1420000              1.0000000        
F   1
  1      9.0036000              1.0000000        
F   1
  1      4.4984200              1.0000000        
F   1
  1      2.8521400              1.0000000        
F   1
  1      1.3385400              1.0000000        
F   1
  1      0.8269030              1.0000000        
F   1
  1      0.3846820              1.0000000        
F   1
  1      0.1844180              1.0000000        
F   1
  1      0.0908160              1.0000000        
G   1
  1     40.7104000              1.0000000        
G   1
  1     15.1368000              1.0000000        
G   1
  1      7.1765900              1.0000000        
G   1
  1      4.3681800              1.0000000        
G   1
  1      2.5322000              1.0000000        
G   1
  1      1.2261700              1.0000000        
G   1
  1      0.6526750              1.0000000        
G   1
  1      0.3038220              1.0000000        
G   1
  1      0.1549830              1.0000000        
H   1
  1     17.8556000              1.0000000        
H   1
  1     10.1186000              1.0000000        
H   1
  1      4.7352500              1.0000000        
H   1
  1      2.9502800              1.0000000        
H   1
  1      1.3430600              1.0000000        
H   1
  1      0.5328350              1.0000000        
I   1
  1     12.3464000              1.0000000        
I   1
  1      6.6767900              1.0000000        
I   1
  1      3.0423500              1.0000000        
I   1
  1      1.8182300              1.0000000        
I   1
  1      0.8878140              1.0000000        
K   1
  1     11.3038000              1.0000000        
K   1
  1      5.1812900              1.0000000        
K   1
  1      3.0282500              1.0000000        
K   1
  1      1.5617300              1.0000000        
L   1
  1      6.1903400              1.0000000        
L   1
  1      3.4789600              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Fe
data:
IRON
S   1
  1    411.1890000              1.0000000        
S   1
  1    219.3440000              1.0000000        
S   1
  1     92.2630000              1.0000000        
S   1
  1     38.9379000              1.0000000        
S   1
  1     14.7748000              1.0000000        
S   1
  1      6.7810200              1.0000000        
S   1
  1      3.6440600              1.0000000        
S   1
  1      1.9916000              1.0000000        
S   1
  1      0.9062710              1.0000000        
S   1
  1      0.5038520              1.0000000        
S   1
  1      0.2307760              1.0000000        
S   1
  1      0.1158460              1.0000000        
S   1
  1      0.0784530              1.0000000        
P   1
  1    158.3620000              1.0000000        
P   1
  1     70.9705000              1.0000000        
P   1
  1     27.6364000              1.0000000        
P   1
  1     11.7256000              1.0000000        
P   1
  1      5.9769000              1.0000000        
P   1
  1      2.7397800              1.0000000        
P   1
  1      1.4854200              1.0000000        
P   1
  1      0.8991700              1.0000000        
P   1
  1      0.6146010              1.0000000        
P   1
  1      0.2896910              1.0000000        
P   1
  1      0.1302510              1.0000000        
P   1
  1      0.0703730              1.0000000        
D   1
  1     36.9160000              1.0000000        
D   1
  1     18.3114000              1.0000000        
D   1
  1      9.2354900              1.0000000        
D   1
  1      5.7967600              1.0000000        
D   1
  1      2.9828500              1.0000000        
D   1
  1      1.9826100              1.0000000        
D   1
  1      0.8107060              1.0000000        
D   1
  1      0.5026580              1.0000000        
D   1
  1      0.2408840              1.0000000        
D   1
  1      0.1231920              1.0000000        
D   1
  1      0.0569370              1.0000000        
F   1
  1     56.8614000              1.0000000        
F   1
  1     17.4576000              1.0000000        
F   1
  1      9.6044400              1.0000000        
F   1
  1      4.9815200              1.0000000        
F   1
  1      3.0770800              1.0000000        
F   1
  1      1.5438700              1.0000000        
F   1
  1      0.8826790              1.0000000        
F   1
  1      0.4397560              1.0000000        
F   1
  1      0.2150220              1.0000000        
F   1
  1      0.0875840              1.0000000        
G   1
  1     44.7336000              1.0000000        
G   1
  1     16.8902000              1.0000000        
G   1
  1      7.9774800              1.0000000        
G   1
  1      4.7210700              1.0000000        
G   1
  1      2.9566300              1.0000000        
G   1
  1      1.4439600              1.0000000        
G   1
  1      0.7932250              1.0000000        
G   1
  1      0.3591730              1.0000000        
G   1
  1      0.1873470              1.0000000        
H   1
  1     20.0636000              1.0000000        
H   1
  1     10.9289000              1.0000000        
H   1
  1      5.6673100              1.0000000        
H   1
  1      3.4618800              1.0000000        
H   1
  1      1.6017100              1.0000000        
H   1
  1      0.6319300              1.0000000        
I   1
  1     14.3505000              1.0000000        
I   1
  1      8.0563600              1.0000000        
I   1
  1      3.7834700              1.0000000        
I   1
  1      2.4641500              1.0000000        
I   1
  1      1.0992300              1.0000000        
K   1
  1     11.8214000              1.0000000        
K   1
  1      6.4062400              1.0000000        
K   1
  1      3.1970600              1.0000000        
K   1
  1      1.8816300              1.0000000        
L   1
  1      7.7814000              1.0000000        
L   1
  1      4.2495800              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Co
data:
COBALT
S   1
  1    432.1520000              1.0000000        
S   1
  1    225.9270000              1.0000000        
S   1
  1     99.2568000              1.0000000        
S   1
  1     44.1779000              1.0000000        
S   1
  1     15.2915000              1.0000000        
S   1
  1      7.1067700              1.0000000        
S   1
  1      3.7253800              1.0000000        
S   1
  1      2.0892300              1.0000000        
S   1
  1      1.0375200              1.0000000        
S   1
  1      0.5495140              1.0000000        
S   1
  1      0.2570860              1.0000000        
S   1
  1      0.1285150              1.0000000        
S   1
  1      0.0867490              1.0000000        
P   1
  1    164.3500000              1.0000000        
P   1
  1     74.9611000              1.0000000        
P   1
  1     30.5499000              1.0000000        
P   1
  1     12.8556000              1.0000000        
P   1
  1      6.8922000              1.0000000        
P   1
  1      3.2684800              1.0000000        
P   1
  1      1.6276200              1.0000000        
P   1
  1      1.0932500              1.0000000        
P   1
  1      0.6244240              1.0000000        
P   1
  1      0.3209090              1.0000000        
P   1
  1      0.1413560              1.0000000        
P   1
  1      0.0735480              1.0000000        
D   1
  1     42.1893000              1.0000000        
D   1
  1     20.1854000              1.0000000        
D   1
  1      9.9394300              1.0000000        
D   1
  1      6.1350100              1.0000000        
D   1
  1      3.2056900              1.0000000        
D   1
  1      2.0670700              1.0000000        
D   1
  1      0.9544640              1.0000000        
D   1
  1      0.5432800              1.0000000        
D   1
  1      0.2772830              1.0000000        
D   1
  1      0.1440420              1.0000000        
D   1
  1      0.0581040              1.0000000        
F   1
  1     66.2260000              1.0000000        
F   1
  1     19.0702000              1.0000000        
F   1
  1     11.0038000              1.0000000        
F   1
  1      5.5802400              1.0000000        
F   1
  1      3.4573500              1.0000000        
F   1
  1      1.7570400              1.0000000        
F   1
  1      0.9857360              1.0000000        
F   1
  1      0.5018100              1.0000000        
F   1
  1      0.2363370              1.0000000        
F   1
  1      0.1089680              1.0000000        
G   1
  1     47.4907000              1.0000000        
G   1
  1     18.4226000              1.0000000        
G   1
  1      8.9498000              1.0000000        
G   1
  1      4.9341300              1.0000000        
G   1
  1      3.4336100              1.0000000        
G   1
  1      1.6428600              1.0000000        
G   1
  1      0.9322760              1.0000000        
G   1
  1      0.3998840              1.0000000        
G   1
  1      0.2039920              1.0000000        
H   1
  1     22.0873000              1.0000000        
H   1
  1     11.4735000              1.0000000        
H   1
  1      6.1211300              1.0000000        
H   1
  1      3.4874800              1.0000000        
H   1
  1      1.8250600              1.0000000        
H   1
  1      0.7235970              1.0000000        
I   1
  1     15.8912000              1.0000000        
I   1
  1      9.1865300              1.0000000        
I   1
  1      4.3933000              1.0000000        
I   1
  1      2.8830600              1.0000000        
I   1
  1      1.2959900              1.0000000        
K   1
  1     12.6816000              1.0000000        
K   1
  1      7.1433900              1.0000000        
K   1
  1      3.2655400              1.0000000        
K   1
  1      2.0462700              1.0000000        
L   1
  1      9.1235000              1.0000000        
L   1
  1      4.9821500              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Ni
data:
NICKEL
S   1
  1    457.0840000              1.0000000        
S   1
  1    239.8970000              1.0000000        
S   1
  1    108.2470000              1.0000000        
S   1
  1     49.1719000              1.0000000        
S   1
  1     17.8895000              1.0000000        
S   1
  1      7.5043000              1.0000000        
S   1
  1      3.9649600              1.0000000        
S   1
  1      2.1186600              1.0000000        
S   1
  1      1.1123600              1.0000000        
S   1
  1      0.5665550              1.0000000        
S   1
  1      0.2763600              1.0000000        
S   1
  1      0.1505550              1.0000000        
S   1
  1      0.0904040              1.0000000        
P   1
  1    176.5170000              1.0000000        
P   1
  1     79.1721000              1.0000000        
P   1
  1     32.8068000              1.0000000        
P   1
  1     14.4264000              1.0000000        
P   1
  1      8.3333900              1.0000000        
P   1
  1      3.4821500              1.0000000        
P   1
  1      1.6832300              1.0000000        
P   1
  1      1.2487600              1.0000000        
P   1
  1      0.6681630              1.0000000        
P   1
  1      0.3154830              1.0000000        
P   1
  1      0.1433670              1.0000000        
P   1
  1      0.0744960              1.0000000        
D   1
  1     46.2583000              1.0000000        
D   1
  1     23.1481000              1.0000000        
D   1
  1     10.9409000              1.0000000        
D   1
  1      7.1479400              1.0000000        
D   1
  1      3.3997400              1.0000000        
D   1
  1      2.3684300              1.0000000        
D   1
  1      1.0880100              1.0000000        
D   1
  1      0.5936540              1.0000000        
D   1
  1      0.3020930              1.0000000        
D   1
  1      0.1601660              1.0000000        
D   1
  1      0.0616970              1.0000000        
F   1
  1     71.5258000              1.0000000        
F   1
  1     21.2206000              1.0000000        
F   1
  1     12.7264000              1.0000000        
F   1
  1      6.1960100              1.0000000        
F   1
  1      4.1926100              1.0000000        
F   1
  1      1.9658000              1.0000000        
F   1
  1      1.1181900              1.0000000        
F   1
  1      0.5628310              1.0000000        
F   1
  1      0.2830350              1.0000000        
F   1
  1      0.1310830              1.0000000        
G   1
  1     54.4630000              1.0000000        
G   1
  1     20.4926000              1.0000000        
G   1
  1      9.7906000              1.0000000        
G   1
  1      5.1728100              1.0000000        
G   1
  1      3.6255800              1.0000000        
G   1
  1      1.7112200              1.0000000        
G   1
  1      1.0577500              1.0000000        
G   1
  1      0.4613740              1.0000000        
G   1
  1      0.2379340              1.0000000        
H   1
  1     25.1598000              1.0000000        
H   1
  1     13.4545000              1.0000000        
H   1
  1      6.6873800              1.0000000        
H   1
  1      3.6524600              1.0000000        
H   1
  1      2.1000100              1.0000000        
H   1
  1      0.8585480              1.0000000        
I   1
  1     16.9962000              1.0000000        
I   1
  1      9.8992600              1.0000000        
I   1
  1      5.0896500              1.0000000        
I   1
  1      3.4040600              1.0000000        
I   1
  1      1.5656200              1.0000000        
K   1
  1     13.9590000              1.0000000        
K   1
  1      8.0774900              1.0000000        
K   1
  1      3.4781400              1.0000000        
K   1
  1      2.1695900              1.0000000        
L   1
  1     10.7906000              1.0000000        
L   1
  1      5.8820100              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Cu
data:
COPPER
S   1
  1    472.2810000              1.0000000        
S   1
  1    248.1180000              1.0000000        
S   1
  1    116.4960000              1.0000000        
S   1
  1     52.3941000              1.0000000        
S   1
  1     20.8846000              1.0000000        
S   1
  1      8.7302600              1.0000000        
S   1
  1      4.2917600              1.0000000        
S   1
  1      2.2133700              1.0000000        
S   1
  1      1.2870200              1.0000000        
S   1
  1      0.5878540              1.0000000        
S   1
  1      0.3356620              1.0000000        
S   1
  1      0.1663080              1.0000000        
S   1
  1      0.0939550              1.0000000        
P   1
  1    183.5390000              1.0000000        
P   1
  1     82.1483000              1.0000000        
P   1
  1     36.7200000              1.0000000        
P   1
  1     15.7580000              1.0000000        
P   1
  1      9.8052100              1.0000000        
P   1
  1      3.9165600              1.0000000        
P   1
  1      1.7510300              1.0000000        
P   1
  1      1.3812400              1.0000000        
P   1
  1      0.7155100              1.0000000        
P   1
  1      0.3365950              1.0000000        
P   1
  1      0.1504370              1.0000000        
P   1
  1      0.0771550              1.0000000        
D   1
  1     49.6498000              1.0000000        
D   1
  1     25.9773000              1.0000000        
D   1
  1     11.8487000              1.0000000        
D   1
  1      8.2504800              1.0000000        
D   1
  1      3.7146000              1.0000000        
D   1
  1      2.6450800              1.0000000        
D   1
  1      1.1800600              1.0000000        
D   1
  1      0.6411530              1.0000000        
D   1
  1      0.3231640              1.0000000        
D   1
  1      0.1619020              1.0000000        
D   1
  1      0.0617210              1.0000000        
F   1
  1     74.1325000              1.0000000        
F   1
  1     22.9342000              1.0000000        
F   1
  1     13.6253000              1.0000000        
F   1
  1      6.6924800              1.0000000        
F   1
  1      4.3901000              1.0000000        
F   1
  1      2.1695500              1.0000000        
F   1
  1      1.1436500              1.0000000        
F   1
  1      0.6267110              1.0000000        
F   1
  1      0.2964070              1.0000000        
F   1
  1      0.1453020              1.0000000        
G   1
  1     57.0703000              1.0000000        
G   1
  1     21.4792000              1.0000000        
G   1
  1     10.8470000              1.0000000        
G   1
  1      5.4039700              1.0000000        
G   1
  1      3.9526900              1.0000000        
G   1
  1      1.7669900              1.0000000        
G   1
  1      1.1017600              1.0000000        
G   1
  1      0.5223930              1.0000000        
G   1
  1      0.2422950              1.0000000        
H   1
  1     26.7010000              1.0000000        
H   1
  1     14.5002000              1.0000000        
H   1
  1      7.4667800              1.0000000        
H   1
  1      3.9377600              1.0000000        
H   1
  1      2.3280300              1.0000000        
H   1
  1      0.9419080              1.0000000        
I   1
  1     18.7476000              1.0000000        
I   1
  1     10.6236000              1.0000000        
I   1
  1      5.6905300              1.0000000        
I   1
  1      3.4880000              1.0000000        
I   1
  1      1.7430300              1.0000000        
K   1
  1     14.7371000              1.0000000        
K   1
  1      8.7099300              1.0000000        
K   1
  1      3.7086600              1.0000000        
K   1
  1      2.2288700              1.0000000        
L   1
  1     11.7993000              1.0000000        
L   1
  1      6.5989000              1.0000000        


name: cc-pV5Z-NR MP2 Fitting
description: MP2 auxiliary basis for use with cc-pV5Z-NR AO basis set
elt: Zn
data:
ZINC
S   1
  1    495.3420000              1.0000000        
S   1
  1    266.1960000              1.0000000        
S   1
  1    125.5760000              1.0000000        
S   1
  1     56.4411000              1.0000000        
S   1
  1     21.3276000              1.0000000        
S   1
  1      9.4360300              1.0000000        
S   1
  1      4.5403600              1.0000000        
S   1
  1      2.2146600              1.0000000        
S   1
  1      1.1239600              1.0000000        
S   1
  1      0.5526220              1.0000000        
S   1
  1      0.2746910              1.0000000        
S   1
  1      0.1426240              1.0000000        
S   1
  1      0.0792470              1.0000000        
P   1
  1    191.6730000              1.0000000        
P   1
  1     86.2505000              1.0000000        
P   1
  1     39.6372000              1.0000000        
P   1
  1     16.3146000              1.0000000        
P   1
  1     10.5730000              1.0000000        
P   1
  1      4.0878000              1.0000000        
P   1
  1      2.1136900              1.0000000        
P   1
  1      1.4062000              1.0000000        
P   1
  1      0.7610600              1.0000000        
P   1
  1      0.3319340              1.0000000        
P   1
  1      0.1653450              1.0000000        
P   1
  1      0.0835240              1.0000000        
D   1
  1     52.8541000              1.0000000        
D   1
  1     26.8722000              1.0000000        
D   1
  1     12.0337000              1.0000000        
D   1
  1      8.5666700              1.0000000        
D   1
  1      3.8380300              1.0000000        
D   1
  1      2.7923700              1.0000000        
D   1
  1      1.3244200              1.0000000        
D   1
  1      0.7058190              1.0000000        
D   1
  1      0.3925640              1.0000000        
D   1
  1      0.2010550              1.0000000        
D   1
  1      0.0651730              1.0000000        
F   1
  1     77.4909000              1.0000000        
F   1
  1     25.2613000              1.0000000        
F   1
  1     14.3196000              1.0000000        
F   1
  1      6.9338800              1.0000000        
F   1
  1      4.1395700              1.0000000        
F   1
  1      2.3100700              1.0000000        
F   1
  1      1.2554200              1.0000000        
F   1
  1      0.7282730              1.0000000        
F   1
  1      0.2980320              1.0000000        
F   1
  1      0.1548630              1.0000000        
G   1
  1     59.3076000              1.0000000        
G   1
  1     22.7846000              1.0000000        
G   1
  1     11.5287000              1.0000000        
G   1
  1      5.6287000              1.0000000        
G   1
  1      3.8478200              1.0000000        
G   1
  1      1.7835500              1.0000000        
G   1
  1      1.2002200              1.0000000        
G   1
  1      0.6002350              1.0000000        
G   1
  1      0.2518700              1.0000000        
H   1
  1     27.1088000              1.0000000        
H   1
  1     15.0903000              1.0000000        
H   1
  1      8.0012000              1.0000000        
H   1
  1      4.2747100              1.0000000        
H   1
  1      2.6022700              1.0000000        
H   1
  1      1.1176500              1.0000000        
I   1
  1     19.7157000              1.0000000        
I   1
  1     11.3479000              1.0000000        
I   1
  1      6.2861400              1.0000000        
I   1
  1      3.9062200              1.0000000        
I   1
  1      1.9630600              1.0000000        
K   1
  1     15.1143000              1.0000000        
K   1
  1      9.2949200              1.0000000        
K   1
  1      4.0489000              1.0000000        
K   1
  1      2.1191000              1.0000000        
L   1
  1     11.9970000              1.0000000        
L   1
  1      7.1986800              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: H
data:
HYDROGEN
S   4
  1    402.0000000              0.0002836        
  2     60.2400000              0.0021692        
  3     13.7300000              0.0112082        
  4      3.9050000              0.0448854        
S   1
  1      1.2830000              1.0000000        
S   1
  1      0.4655000              1.0000000        
S   1
  1      0.1811000              1.0000000        
S   1
  1      0.0727900              1.0000000        
P   1
  1      4.5160000              1.0000000        
P   1
  1      1.7120000              1.0000000        
P   1
  1      0.6490000              1.0000000        
P   1
  1      0.2460000              1.0000000        
D   1
  1      2.9500000              1.0000000        
D   1
  1      1.2060000              1.0000000        
D   1
  1      0.4930000              1.0000000        
F   1
  1      2.5060000              1.0000000        
F   1
  1      0.8750000              1.0000000        
G   1
  1      2.3580000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: He
data:
HELIUM
S   4
  1   1145.0000000              0.0003739        
  2    171.7000000              0.0027855        
  3     39.0700000              0.0142748        
  4     11.0400000              0.0555936        
S   1
  1      3.5660000              1.0000000        
S   1
  1      1.2400000              1.0000000        
S   1
  1      0.4473000              1.0000000        
S   1
  1      0.1640000              1.0000000        
P   1
  1     10.1530000              1.0000000        
P   1
  1      3.6270000              1.0000000        
P   1
  1      1.2960000              1.0000000        
P   1
  1      0.4630000              1.0000000        
D   1
  1      7.6660000              1.0000000        
D   1
  1      2.6470000              1.0000000        
D   1
  1      0.9140000              1.0000000        
F   1
  1      5.4110000              1.0000000        
F   1
  1      1.7070000              1.0000000        
G   1
  1      3.4300000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Li
data:
LITHIUM
S   10
  1  29493.0000000              0.0000308        
  2   4417.1010000              0.0001585        
  3   1005.2230000              0.0007631        
  4    284.7009000              0.0031385        
  5     92.8654300              0.0111780        
  6     33.5117900              0.0347254        
  7     13.0418000              0.0922281        
  8      5.3575360              0.1996078        
  9      2.2793380              0.3288176        
 10      0.9939900              0.3459155        
S   10
  1  29493.0000000             -0.0000048        
  2   4417.1010000             -0.0000248        
  3   1005.2230000             -0.0001191        
  4    284.7009000             -0.0004923        
  5     92.8654300             -0.0017532        
  6     33.5117900             -0.0055299        
  7     13.0418000             -0.0149394        
  8      5.3575360             -0.0342193        
  9      2.2793380             -0.0621550        
 10      0.9939900             -0.0959173        
S   1
  1      0.4334710              1.0000000        
S   1
  1      0.0955660              1.0000000        
S   1
  1      0.0446570              1.0000000        
S   1
  1      0.0206330              1.0000000        
P   3
  1     11.2500000              0.0013145        
  2      2.5000000              0.0099188        
  3      0.6500000              0.0375383        
P   1
  1      0.2500000              1.0000000        
P   1
  1      0.1000000              1.0000000        
P   1
  1      0.0390000              1.0000000        
P   1
  1      0.0170000              1.0000000        
D   1
  1      0.5500000              1.0000000        
D   1
  1      0.2900000              1.0000000        
D   1
  1      0.1400000              1.0000000        
D   1
  1      0.0610000              1.0000000        
F   1
  1      0.3500000              1.0000000        
F   1
  1      0.2200000              1.0000000        
F   1
  1      0.1100000              1.0000000        
G   1
  1      0.3200000              1.0000000        
G   1
  1      0.1600000              1.0000000        
H   1
  1      0.3200000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Be
data:
BERYLLIUM
S   10
  1  54620.0000000              0.0000368        
  2   8180.0000000              0.0001689        
  3   1862.0000000              0.0007659        
  4    527.3000000              0.0030956        
  5    172.0000000              0.0109871        
  6     62.1000000              0.0341375        
  7     24.2100000              0.0913020        
  8      9.9930000              0.1993370        
  9      4.3050000              0.3293238        
 10      1.9210000              0.3403756        
S   10
  1  54620.0000000             -0.0000067        
  2   8180.0000000             -0.0000309        
  3   1862.0000000             -0.0001392        
  4    527.3000000             -0.0005685        
  5    172.0000000             -0.0020037        
  6     62.1000000             -0.0063922        
  7     24.2100000             -0.0172438        
  8      9.9930000             -0.0408891        
  9      4.3050000             -0.0742441        
 10      1.9210000             -0.1192494        
S   1
  1      0.8663000              1.0000000        
S   1
  1      0.2475000              1.0000000        
S   1
  1      0.1009000              1.0000000        
S   1
  1      0.0412900              1.0000000        
P   4
  1     43.7500000              0.0006379        
  2     10.3300000              0.0048129        
  3      3.2260000              0.0205437        
  4      1.1270000              0.0677937        
P   1
  1      0.4334000              1.0000000        
P   1
  1      0.1808000              1.0000000        
P   1
  1      0.0782700              1.0000000        
P   1
  1      0.0337200              1.0000000        
D   1
  1      1.6350000              1.0000000        
D   1
  1      0.7410000              1.0000000        
D   1
  1      0.3350000              1.0000000        
D   1
  1      0.1519000              1.0000000        
F   1
  1      0.6860000              1.0000000        
F   1
  1      0.4010000              1.0000000        
F   1
  1      0.2350000              1.0000000        
G   1
  1      0.6030000              1.0000000        
G   1
  1      0.3240000              1.0000000        
H   1
  1      0.5100000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: B
data:
BORON
S   10
  1  68260.0000000              0.0000537        
  2  10230.0000000              0.0002368        
  3   2328.0000000              0.0010435        
  4    660.4000000              0.0041536        
  5    216.2000000              0.0145345        
  6     78.6000000              0.0440738        
  7     30.9800000              0.1132317        
  8     12.9600000              0.2339126        
  9      5.6590000              0.3538666        
 10      2.5560000              0.3013336        
S   10
  1  68260.0000000             -0.0000108        
  2  10230.0000000             -0.0000479        
  3   2328.0000000             -0.0002105        
  4    660.4000000             -0.0008445        
  5    216.2000000             -0.0029525        
  6     78.6000000             -0.0091801        
  7     30.9800000             -0.0241582        
  8     12.9600000             -0.0548104        
  9      5.6590000             -0.0969649        
 10      2.5560000             -0.1374497        
S   1
  1      1.1750000              1.0000000        
S   1
  1      0.4249000              1.0000000        
S   1
  1      0.1712000              1.0000000        
S   1
  1      0.0691300              1.0000000        
P   4
  1     66.4400000              0.0008470        
  2     15.7100000              0.0064213        
  3      4.9360000              0.0280951        
  4      1.7700000              0.0921533        
P   1
  1      0.7008000              1.0000000        
P   1
  1      0.2901000              1.0000000        
P   1
  1      0.1211000              1.0000000        
P   1
  1      0.0497300              1.0000000        
D   1
  1      2.0100000              1.0000000        
D   1
  1      0.7960000              1.0000000        
D   1
  1      0.3160000              1.0000000        
D   1
  1      0.1250000              1.0000000        
F   1
  1      1.2150000              1.0000000        
F   1
  1      0.5250000              1.0000000        
F   1
  1      0.2270000              1.0000000        
G   1
  1      1.1240000              1.0000000        
G   1
  1      0.4610000              1.0000000        
H   1
  1      0.8340000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: C
data:
CARBON
S   10
  1  96770.0000000              0.0000632        
  2  14500.0000000              0.0002632        
  3   3300.0000000              0.0011075        
  4    935.8000000              0.0043269        
  5    306.2000000              0.0150594        
  6    111.3000000              0.0455571        
  7     43.9000000              0.1167649        
  8     18.4000000              0.2403782        
  9      8.0540000              0.3586480        
 10      3.6370000              0.2936178        
S   10
  1  96770.0000000             -0.0000135        
  2  14500.0000000             -0.0000562        
  3   3300.0000000             -0.0002360        
  4    935.8000000             -0.0009284        
  5    306.2000000             -0.0032339        
  6    111.3000000             -0.0100282        
  7     43.9000000             -0.0264616        
  8     18.4000000             -0.0600921        
  9      8.0540000             -0.1068653        
 10      3.6370000             -0.1440792        
S   1
  1      1.6560000              1.0000000        
S   1
  1      0.6333000              1.0000000        
S   1
  1      0.2545000              1.0000000        
S   1
  1      0.1019000              1.0000000        
P   4
  1    101.8000000              0.0009056        
  2     24.0400000              0.0069992        
  3      7.5710000              0.0317022        
  4      2.7320000              0.1040291        
P   1
  1      1.0850000              1.0000000        
P   1
  1      0.4496000              1.0000000        
P   1
  1      0.1876000              1.0000000        
P   1
  1      0.0760600              1.0000000        
D   1
  1      3.1340000              1.0000000        
D   1
  1      1.2330000              1.0000000        
D   1
  1      0.4850000              1.0000000        
D   1
  1      0.1910000              1.0000000        
F   1
  1      2.0060000              1.0000000        
F   1
  1      0.8380000              1.0000000        
F   1
  1      0.3500000              1.0000000        
G   1
  1      1.7530000              1.0000000        
G   1
  1      0.6780000              1.0000000        
H   1
  1      1.2590000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: N
data:
NITROGEN
S   10
  1 129200.0000000              0.0000735        
  2  19350.0000000              0.0002922        
  3   4404.0000000              0.0011810        
  4   1248.0000000              0.0045238        
  5    408.0000000              0.0156583        
  6    148.2000000              0.0472237        
  7     58.5000000              0.1204792        
  8     24.5900000              0.2458705        
  9     10.8100000              0.3611534        
 10      4.8820000              0.2868296        
S   10
  1 129200.0000000             -0.0000162        
  2  19350.0000000             -0.0000645        
  3   4404.0000000             -0.0002605        
  4   1248.0000000             -0.0010041        
  5    408.0000000             -0.0034840        
  6    148.2000000             -0.0107657        
  7     58.5000000             -0.0284074        
  8     24.5900000             -0.0641548        
  9     10.8100000             -0.1139907        
 10      4.8820000             -0.1468330        
S   1
  1      2.1950000              1.0000000        
S   1
  1      0.8715000              1.0000000        
S   1
  1      0.3504000              1.0000000        
S   1
  1      0.1397000              1.0000000        
P   4
  1    147.0000000              0.0009130        
  2     34.7600000              0.0071180        
  3     11.0000000              0.0328740        
  4      3.9950000              0.1082582        
P   1
  1      1.5870000              1.0000000        
P   1
  1      0.6533000              1.0000000        
P   1
  1      0.2686000              1.0000000        
P   1
  1      0.1067000              1.0000000        
D   1
  1      4.6470000              1.0000000        
D   1
  1      1.8130000              1.0000000        
D   1
  1      0.7070000              1.0000000        
D   1
  1      0.2760000              1.0000000        
F   1
  1      2.9420000              1.0000000        
F   1
  1      1.2040000              1.0000000        
F   1
  1      0.4930000              1.0000000        
G   1
  1      2.5110000              1.0000000        
G   1
  1      0.9420000              1.0000000        
H   1
  1      1.7680000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: O
data:
OXYGEN
S   10
  1 164200.0000000              0.0000847        
  2  24590.0000000              0.0003254        
  3   5592.0000000              0.0012721        
  4   1582.0000000              0.0047875        
  5    516.1000000              0.0164789        
  6    187.2000000              0.0495613        
  7     73.9300000              0.1253375        
  8     31.2200000              0.2519061        
  9     13.8100000              0.3620957        
 10      6.2560000              0.2784501        
S   10
  1 164200.0000000             -0.0000192        
  2  24590.0000000             -0.0000740        
  3   5592.0000000             -0.0002892        
  4   1582.0000000             -0.0010942        
  5    516.1000000             -0.0037817        
  6    187.2000000             -0.0116510        
  7     73.9300000             -0.0306158        
  8     31.2200000             -0.0683335        
  9     13.8100000             -0.1204494        
 10      6.2560000             -0.1479838        
S   1
  1      2.7760000              1.0000000        
S   1
  1      1.1380000              1.0000000        
S   1
  1      0.4600000              1.0000000        
S   1
  1      0.1829000              1.0000000        
P   4
  1    195.5000000              0.0009467        
  2     46.1600000              0.0074404        
  3     14.5800000              0.0350458        
  4      5.2960000              0.1155141        
P   1
  1      2.0940000              1.0000000        
P   1
  1      0.8471000              1.0000000        
P   1
  1      0.3368000              1.0000000        
P   1
  1      0.1285000              1.0000000        
D   1
  1      5.8790000              1.0000000        
D   1
  1      2.3070000              1.0000000        
D   1
  1      0.9050000              1.0000000        
D   1
  1      0.3550000              1.0000000        
F   1
  1      4.0160000              1.0000000        
F   1
  1      1.5540000              1.0000000        
F   1
  1      0.6010000              1.0000000        
G   1
  1      3.3500000              1.0000000        
G   1
  1      1.1890000              1.0000000        
H   1
  1      2.3190000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: F
data:
FLUORINE
S   10
  1 211400.0000000              0.0000930        
  2  31660.0000000              0.0003455        
  3   7202.0000000              0.0013010        
  4   2040.0000000              0.0047689        
  5    666.4000000              0.0162341        
  6    242.0000000              0.0487165        
  7     95.5300000              0.1238528        
  8     40.2300000              0.2518163        
  9     17.7200000              0.3641114        
 10      8.0050000              0.2789899        
S   10
  1 211400.0000000             -0.0000216        
  2  31660.0000000             -0.0000802        
  3   7202.0000000             -0.0003019        
  4   2040.0000000             -0.0011126        
  5    666.4000000             -0.0038036        
  6    242.0000000             -0.0116901        
  7     95.5300000             -0.0309010        
  8     40.2300000             -0.0698228        
  9     17.7200000             -0.1241027        
 10      8.0050000             -0.1498326        
S   1
  1      3.5380000              1.0000000        
S   1
  1      1.4580000              1.0000000        
S   1
  1      0.5887000              1.0000000        
S   1
  1      0.2324000              1.0000000        
P   4
  1    241.9000000              0.0010403        
  2     57.1700000              0.0081268        
  3     18.1300000              0.0381727        
  4      6.6240000              0.1238970        
P   1
  1      2.6220000              1.0000000        
P   1
  1      1.0570000              1.0000000        
P   1
  1      0.4176000              1.0000000        
P   1
  1      0.1574000              1.0000000        
D   1
  1      7.7600000              1.0000000        
D   1
  1      3.0320000              1.0000000        
D   1
  1      1.1850000              1.0000000        
D   1
  1      0.4630000              1.0000000        
F   1
  1      5.3980000              1.0000000        
F   1
  1      2.0780000              1.0000000        
F   1
  1      0.8000000              1.0000000        
G   1
  1      4.3380000              1.0000000        
G   1
  1      1.5130000              1.0000000        
H   1
  1      2.9950000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Ne
data:
NEON
S   10
  1 262700.0000000              0.0001022        
  2  39350.0000000              0.0003692        
  3   8955.0000000              0.0013479        
  4   2538.0000000              0.0048167        
  5    829.9000000              0.0162272        
  6    301.5000000              0.0485086        
  7    119.0000000              0.1237207        
  8     50.0000000              0.2528620        
  9     21.9800000              0.3657906        
 10      9.8910000              0.2786426        
S   10
  1 262700.0000000             -0.0000241        
  2  39350.0000000             -0.0000870        
  3   8955.0000000             -0.0003177        
  4   2538.0000000             -0.0011407        
  5    829.9000000             -0.0038624        
  6    301.5000000             -0.0118165        
  7    119.0000000             -0.0313900        
  8     50.0000000             -0.0712957        
  9     21.9800000             -0.1274079        
 10      9.8910000             -0.1507104        
S   1
  1      4.3270000              1.0000000        
S   1
  1      1.8040000              1.0000000        
S   1
  1      0.7288000              1.0000000        
S   1
  1      0.2867000              1.0000000        
P   4
  1    299.1000000              0.0010879        
  2     70.7300000              0.0084708        
  3     22.4800000              0.0398612        
  4      8.2460000              0.1282151        
P   1
  1      3.2690000              1.0000000        
P   1
  1      1.3150000              1.0000000        
P   1
  1      0.5158000              1.0000000        
P   1
  1      0.1918000              1.0000000        
D   1
  1      9.8370000              1.0000000        
D   1
  1      3.8440000              1.0000000        
D   1
  1      1.5020000              1.0000000        
D   1
  1      0.5870000              1.0000000        
F   1
  1      7.0900000              1.0000000        
F   1
  1      2.7380000              1.0000000        
F   1
  1      1.0570000              1.0000000        
G   1
  1      5.4600000              1.0000000        
G   1
  1      1.8800000              1.0000000        
H   1
  1      3.7760000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Na
data:
SODIUM
S   15
  1 1224000.0000000             0.0000384        
  2 183200.0000000              0.0001214        
  3  41700.0000000              0.0003735        
  4  11810.0000000              0.0011226        
  5   3853.0000000              0.0034243        
  6   1391.0000000              0.0102715        
  7    542.5000000              0.0289918        
  8    224.9000000              0.0741036        
  9     97.9300000              0.1636649        
 10     44.3100000              0.2887998        
 11     20.6500000              0.3459070        
 12      9.7290000              0.2058713        
 13      4.2280000              0.0325950        
 14      1.9690000             -0.0006392        
 15      0.8890000              0.0014474        
S   15
  1 1224000.0000000            -0.0000094        
  2 183200.0000000             -0.0000297        
  3  41700.0000000             -0.0000916        
  4  11810.0000000             -0.0002753        
  5   3853.0000000             -0.0008427        
  6   1391.0000000             -0.0025382        
  7    542.5000000             -0.0072706        
  8    224.9000000             -0.0190949        
  9     97.9300000             -0.0450056        
 10     44.3100000             -0.0901063        
 11     20.6500000             -0.1429400        
 12      9.7290000             -0.1232733        
 13      4.2280000              0.1016495        
 14      1.9690000              0.4178921        
 15      0.8890000              0.4740231        
S   15
  1 1224000.0000000             0.0000014        
  2 183200.0000000              0.0000045        
  3  41700.0000000              0.0000138        
  4  11810.0000000              0.0000414        
  5   3853.0000000              0.0001269        
  6   1391.0000000              0.0003813        
  7    542.5000000              0.0010962        
  8    224.9000000              0.0028743        
  9     97.9300000              0.0068266        
 10     44.3100000              0.0137060        
 11     20.6500000              0.0222733        
 12      9.7290000              0.0194615        
 13      4.2280000             -0.0171479        
 14      1.9690000             -0.0774282        
 15      0.8890000             -0.1139147        
S   1
  1      0.3964000              1.0000000        
S   1
  1      0.0699300              1.0000000        
S   1
  1      0.0328900              1.0000000        
S   1
  1      0.0161200              1.0000000        
P   8
  1    413.4000000              0.0009678        
  2     97.9800000              0.0075358        
  3     31.3700000              0.0359650        
  4     11.6200000              0.1187550        
  5      4.6710000              0.2614638        
  6      1.9180000              0.3782233        
  7      0.7775000              0.3344927        
  8      0.3013000              0.1267953        
P   8
  1    413.4000000             -0.0000961        
  2     97.9800000             -0.0007513        
  3     31.3700000             -0.0035957        
  4     11.6200000             -0.0120397        
  5      4.6710000             -0.0267252        
  6      1.9180000             -0.0392593        
  7      0.7775000             -0.0375978        
  8      0.3013000             -0.0433062        
P   1
  1      0.2275000              1.0000000        
P   1
  1      0.0752700              1.0000000        
P   1
  1      0.0312600              1.0000000        
P   1
  1      0.0134200              1.0000000        
D   1
  1      0.2734000              1.0000000        
D   1
  1      0.1538000              1.0000000        
D   1
  1      0.0865000              1.0000000        
D   1
  1      0.0487000              1.0000000        
F   1
  1      0.4000000              1.0000000        
F   1
  1      0.1912000              1.0000000        
F   1
  1      0.1036000              1.0000000        
G   1
  1      0.4250000              1.0000000        
G   1
  1      0.1722000              1.0000000        
H   1
  1      0.2000000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Mg
data:
MAGNESIUM
S   16
  1 2968000.0000000             0.0000243        
  2 444300.0000000              0.0000735        
  3 101100.0000000              0.0002116        
  4  28640.0000000              0.0005811        
  5   9343.0000000              0.0016179        
  6   3373.0000000              0.0045591        
  7   1316.0000000              0.0126719        
  8    545.8000000              0.0333255        
  9    238.1000000              0.0799656        
 10    108.2000000              0.1674148        
 11     50.8000000              0.2829195        
 12     24.4800000              0.3308149        
 13     11.9300000              0.2021286        
 14      5.5430000              0.0380060        
 15      2.6750000              0.0003102        
 16      1.2630000              0.0013785        
S   16
  1 2968000.0000000            -0.0000062        
  2 444300.0000000             -0.0000186        
  3 101100.0000000             -0.0000537        
  4  28640.0000000             -0.0001475        
  5   9343.0000000             -0.0004112        
  6   3373.0000000             -0.0011629        
  7   1316.0000000             -0.0032514        
  8    545.8000000             -0.0086888        
  9    238.1000000             -0.0215021        
 10    108.2000000             -0.0481534        
 11     50.8000000             -0.0928013        
 12     24.4800000             -0.1424998        
 13     11.9300000             -0.1249855        
 14      5.5430000              0.0735193        
 15      2.6750000              0.3841734        
 16      1.2630000              0.4890944        
S   16
  1 2968000.0000000             0.0000012        
  2 444300.0000000              0.0000036        
  3 101100.0000000              0.0000103        
  4  28640.0000000              0.0000284        
  5   9343.0000000              0.0000793        
  6   3373.0000000              0.0002238        
  7   1316.0000000              0.0006283        
  8    545.8000000              0.0016728        
  9    238.1000000              0.0041728        
 10    108.2000000              0.0093189        
 11     50.8000000              0.0183032        
 12     24.4800000              0.0282619        
 13     11.9300000              0.0262983        
 14      5.5430000             -0.0177707        
 15      2.6750000             -0.0887568        
 16      1.2630000             -0.1643819        
S   1
  1      0.5883000              1.0000000        
S   1
  1      0.1496000              1.0000000        
S   1
  1      0.0670000              1.0000000        
S   1
  1      0.0295200              1.0000000        
P   10
  1   1441.0000000              0.0001832        
  2    341.4000000              0.0013930        
  3    110.7000000              0.0073620        
  4     41.9700000              0.0287478        
  5     17.4900000              0.0868321        
  6      7.7530000              0.1951182        
  7      3.5340000              0.3119784        
  8      1.6140000              0.3482324        
  9      0.7299000              0.2187540        
 10      0.3029000              0.0435835        
P   10
  1   1441.0000000              0.0000289        
  2    341.4000000              0.0002204        
  3    110.7000000              0.0011644        
  4     41.9700000              0.0045851        
  5     17.4900000              0.0139642        
  6      7.7530000              0.0320203        
  7      3.5340000              0.0514466        
  8      1.6140000              0.0610676        
  9      0.7299000              0.0442817        
 10      0.3029000             -0.0518464        
P   1
  1      0.1583000              1.0000000        
P   1
  1      0.0819000              1.0000000        
P   1
  1      0.0412300              1.0000000        
P   1
  1      0.0198800              1.0000000        
D   1
  1      0.1100000              1.0000000        
D   1
  1      0.2420000              1.0000000        
D   1
  1      0.5320000              1.0000000        
D   1
  1      1.1710000              1.0000000        
F   1
  1      0.1550000              1.0000000        
F   1
  1      0.2640000              1.0000000        
F   1
  1      0.4480000              1.0000000        
G   1
  1      0.2400000              1.0000000        
G   1
  1      0.4440000              1.0000000        
H   1
  1      0.3750000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Al
data:
ALUMINUM
S   16
  1 3269000.0000000             0.0000279        
  2 489400.0000000              0.0000839        
  3 111400.0000000              0.0002399        
  4  31560.0000000              0.0006513        
  5  10320.0000000              0.0017858        
  6   3731.0000000              0.0049799        
  7   1456.0000000              0.0137300        
  8    604.1000000              0.0359019        
  9    263.5000000              0.0855782        
 10    119.8000000              0.1768599        
 11     56.3200000              0.2920412        
 12     27.1900000              0.3268686        
 13     13.2600000              0.1856290        
 14      6.0520000              0.0307664        
 15      2.9810000             -0.0005007        
 16      1.4760000              0.0014759        
S   16
  1 3269000.0000000            -0.0000073        
  2 489400.0000000             -0.0000219        
  3 111400.0000000             -0.0000626        
  4  31560.0000000             -0.0001702        
  5  10320.0000000             -0.0004672        
  6   3731.0000000             -0.0013087        
  7   1456.0000000             -0.0036284        
  8    604.1000000             -0.0096625        
  9    263.5000000             -0.0237777        
 10    119.8000000             -0.0529214        
 11     56.3200000             -0.1003964        
 12     27.1900000             -0.1504104        
 13     13.2600000             -0.1174918        
 14      6.0520000              0.1105978        
 15      2.9810000              0.4121342        
 16      1.4760000              0.4557585        
S   16
  1 3269000.0000000             0.0000017        
  2 489400.0000000              0.0000051        
  3 111400.0000000              0.0000145        
  4  31560.0000000              0.0000393        
  5  10320.0000000              0.0001080        
  6   3731.0000000              0.0003019        
  7   1456.0000000              0.0008402        
  8    604.1000000              0.0022314        
  9    263.5000000              0.0055325        
 10    119.8000000              0.0123043        
 11     56.3200000              0.0238004        
 12     27.1900000              0.0360536        
 13     13.2600000              0.0299391        
 14      6.0520000             -0.0317138        
 15      2.9810000             -0.1194780        
 16      1.4760000             -0.2115977        
S   1
  1      0.7334000              1.0000000        
S   1
  1      0.2447000              1.0000000        
S   1
  1      0.1088000              1.0000000        
S   1
  1      0.0467200              1.0000000        
P   8
  1   1461.0000000              0.0002520        
  2    346.2000000              0.0019027        
  3    112.2000000              0.0099353        
  4     42.5100000              0.0381437        
  5     17.7200000              0.1112827        
  6      7.8520000              0.2344609        
  7      3.5710000              0.3450972        
  8      1.6370000              0.3310962        
P   8
  1   1461.0000000             -0.0000450        
  2    346.2000000             -0.0003450        
  3    112.2000000             -0.0017778        
  4     42.5100000             -0.0070014        
  5     17.7200000             -0.0203367        
  6      7.8520000             -0.0448542        
  7      3.5710000             -0.0642344        
  8      1.6370000             -0.0751187        
P   1
  1      0.7382000              1.0000000        
P   1
  1      0.2577000              1.0000000        
P   1
  1      0.0977300              1.0000000        
P   1
  1      0.0369000              1.0000000        
D   1
  1      1.3170000              1.0000000        
D   1
  1      0.5260000              1.0000000        
D   1
  1      0.2100000              1.0000000        
D   1
  1      0.0840000              1.0000000        
F   1
  1      0.1300000              1.0000000        
F   1
  1      0.2580000              1.0000000        
F   1
  1      0.5130000              1.0000000        
G   1
  1      0.2520000              1.0000000        
G   1
  1      0.5430000              1.0000000        
H   1
  1      0.4460000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Si
data:
SILICON
S   16
  1 3948000.0000000             0.0000294        
  2 591100.0000000              0.0000878        
  3 134500.0000000              0.0002479        
  4  38120.0000000              0.0006613        
  5  12460.0000000              0.0017789        
  6   4504.0000000              0.0048649        
  7   1758.0000000              0.0132602        
  8    729.1000000              0.0345542        
  9    318.0000000              0.0824097        
 10    144.6000000              0.1714365        
 11     67.9700000              0.2869010        
 12     32.8200000              0.3288159        
 13     16.0300000              0.1950359        
 14      7.3960000              0.0350821        
 15      3.6610000             -0.0005172        
 16      1.8230000              0.0015899        
S   16
  1 3948000.0000000            -0.0000079        
  2 591100.0000000             -0.0000235        
  3 134500.0000000             -0.0000663        
  4  38120.0000000             -0.0001771        
  5  12460.0000000             -0.0004769        
  6   4504.0000000             -0.0013099        
  7   1758.0000000             -0.0035911        
  8    729.1000000             -0.0095231        
  9    318.0000000             -0.0234390        
 10    144.6000000             -0.0523952        
 11     67.9700000             -0.1004608        
 12     32.8200000             -0.1526095        
 13     16.0300000             -0.1256202        
 14      7.3960000              0.0976938        
 15      3.6610000              0.4153542        
 16      1.8230000              0.4661065        
S   16
  1 3948000.0000000             0.0000020        
  2 591100.0000000              0.0000060        
  3 134500.0000000              0.0000170        
  4  38120.0000000              0.0000454        
  5  12460.0000000              0.0001223        
  6   4504.0000000              0.0003354        
  7   1758.0000000              0.0009227        
  8    729.1000000              0.0024408        
  9    318.0000000              0.0060521        
 10    144.6000000              0.0135275        
 11     67.9700000              0.0264494        
 12     32.8200000              0.0407085        
 13     16.0300000              0.0356346        
 14      7.3960000             -0.0314431        
 15      3.6610000             -0.1365920        
 16      1.8230000             -0.2505096        
S   1
  1      0.9147000              1.0000000        
S   1
  1      0.3393000              1.0000000        
S   1
  1      0.1500000              1.0000000        
S   1
  1      0.0643800              1.0000000        
P   8
  1   1780.0000000              0.0002517        
  2    421.8000000              0.0018584        
  3    136.7000000              0.0097210        
  4     51.8100000              0.0376181        
  5     21.6000000              0.1112485        
  6      9.5630000              0.2381666        
  7      4.3500000              0.3535235        
  8      2.0060000              0.3283908        
P   8
  1   1780.0000000             -0.0000535        
  2    421.8000000             -0.0004003        
  3    136.7000000             -0.0020734        
  4     51.8100000             -0.0082098        
  5     21.6000000             -0.0243246        
  6      9.5630000             -0.0543990        
  7      4.3500000             -0.0798067        
  8      2.0060000             -0.0886955        
P   1
  1      0.9205000              1.0000000        
P   1
  1      0.3500000              1.0000000        
P   1
  1      0.1381000              1.0000000        
P   1
  1      0.0533800              1.0000000        
D   1
  1      0.1260000              1.0000000        
D   1
  1      0.3210000              1.0000000        
D   1
  1      0.8170000              1.0000000        
D   1
  1      2.0820000              1.0000000        
F   1
  1      0.1690000              1.0000000        
F   1
  1      0.3410000              1.0000000        
F   1
  1      0.6880000              1.0000000        
G   1
  1      0.3200000              1.0000000        
G   1
  1      0.7050000              1.0000000        
H   1
  1      0.5830000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: P
data:
PHOSPHOROUS
S   16
  1 4666000.0000000             0.0000312        
  2 698600.0000000              0.0000923        
  3 159000.0000000              0.0002580        
  4  45040.0000000              0.0006791        
  5  14720.0000000              0.0017930        
  6   5323.0000000              0.0048227        
  7   2076.0000000              0.0130048        
  8    861.1000000              0.0336699        
  9    375.7000000              0.0803050        
 10    170.8000000              0.1678076        
 11     80.2900000              0.2831302        
 12     38.7700000              0.3302241        
 13     18.9300000              0.2015027        
 14      8.7960000              0.0378599        
 15      4.3580000             -0.0003728        
 16      2.1740000              0.0015656        
S   16
  1 4666000.0000000            -0.0000085        
  2 698600.0000000             -0.0000252        
  3 159000.0000000             -0.0000704        
  4  45040.0000000             -0.0001857        
  5  14720.0000000             -0.0004908        
  6   5323.0000000             -0.0013258        
  7   2076.0000000             -0.0035962        
  8    861.1000000             -0.0094717        
  9    375.7000000             -0.0233063        
 10    170.8000000             -0.0522688        
 11     80.2900000             -0.1008524        
 12     38.7700000             -0.1549401        
 13     18.9300000             -0.1316378        
 14      8.7960000              0.0913914        
 15      4.3580000              0.4241997        
 16      2.1740000              0.4725749        
S   16
  1 4666000.0000000             0.0000023        
  2 698600.0000000              0.0000069        
  3 159000.0000000              0.0000194        
  4  45040.0000000              0.0000510        
  5  14720.0000000              0.0001350        
  6   5323.0000000              0.0003641        
  7   2076.0000000              0.0009907        
  8    861.1000000              0.0026049        
  9    375.7000000              0.0064524        
 10    170.8000000              0.0144890        
 11     80.2900000              0.0284834        
 12     38.7700000              0.0444807        
 13     18.9300000              0.0400713        
 14      8.7960000             -0.0315077        
 15      4.3580000             -0.1538392        
 16      2.1740000             -0.2825682        
S   1
  1      1.0950000              1.0000000        
S   1
  1      0.4400000              1.0000000        
S   1
  1      0.1945000              1.0000000        
S   1
  1      0.0837600              1.0000000        
P   8
  1   2010.0000000              0.0002769        
  2    476.3000000              0.0020083        
  3    154.4000000              0.0104679        
  4     58.5100000              0.0404643        
  5     24.4000000              0.1191580        
  6     10.8000000              0.2520962        
  7      4.9130000              0.3663328        
  8      2.2690000              0.3156039        
P   8
  1   2010.0000000             -0.0000657        
  2    476.3000000             -0.0004800        
  3    154.4000000             -0.0024937        
  4     58.5100000             -0.0098133        
  5     24.4000000             -0.0292374        
  6     10.8000000             -0.0642077        
  7      4.9130000             -0.0943888        
  8      2.2690000             -0.0931728        
P   1
  1      1.0430000              1.0000000        
P   1
  1      0.4313000              1.0000000        
P   1
  1      0.1767000              1.0000000        
P   1
  1      0.0700900              1.0000000        
D   1
  1      0.1660000              1.0000000        
D   1
  1      0.4180000              1.0000000        
D   1
  1      1.0540000              1.0000000        
D   1
  1      2.6560000              1.0000000        
F   1
  1      0.2190000              1.0000000        
F   1
  1      0.4500000              1.0000000        
F   1
  1      0.9230000              1.0000000        
G   1
  1      0.4120000              1.0000000        
G   1
  1      0.9030000              1.0000000        
H   1
  1      0.7450000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: S
data:
SULFUR
S   16
  1 5481000.0000000             0.0000328        
  2 820600.0000000              0.0000965        
  3 186700.0000000              0.0002674        
  4  52880.0000000              0.0006950        
  5  17250.0000000              0.0018131        
  6   6226.0000000              0.0047933        
  7   2429.0000000              0.0127678        
  8   1007.0000000              0.0328808        
  9    439.5000000              0.0783067        
 10    199.8000000              0.1642724        
 11     93.9200000              0.2795005        
 12     45.3400000              0.3312368        
 13     22.1500000              0.2076745        
 14     10.3400000              0.0410331        
 15      5.1190000             -0.0004359        
 16      2.5530000              0.0016591        
S   16
  1 5481000.0000000             0.0000091        
  2 820600.0000000              0.0000268        
  3 186700.0000000              0.0000743        
  4  52880.0000000              0.0001934        
  5  17250.0000000              0.0005053        
  6   6226.0000000              0.0013415        
  7   2429.0000000              0.0035955        
  8   1007.0000000              0.0094142        
  9    439.5000000              0.0231295        
 10    199.8000000              0.0519920        
 11     93.9200000              0.1010187        
 12     45.3400000              0.1566751        
 13     22.1500000              0.1372632        
 14     10.3400000             -0.0851826        
 15      5.1190000             -0.4328270        
 16      2.5530000             -0.4788203        
S   16
  1 5481000.0000000             0.0000026        
  2 820600.0000000              0.0000078        
  3 186700.0000000              0.0000216        
  4  52880.0000000              0.0000562        
  5  17250.0000000              0.0001468        
  6   6226.0000000              0.0003895        
  7   2429.0000000              0.0010464        
  8   1007.0000000              0.0027373        
  9    439.5000000              0.0067651        
 10    199.8000000              0.0152463        
 11     93.9200000              0.0301488        
 12     45.3400000              0.0476773        
 13     22.1500000              0.0441522        
 14     10.3400000             -0.0309087        
 15      5.1190000             -0.1702444        
 16      2.5530000             -0.3108554        
S   1
  1      1.2820000              1.0000000        
S   1
  1      0.5450000              1.0000000        
S   1
  1      0.2411000              1.0000000        
S   1
  1      0.1035000              1.0000000        
P   8
  1   2200.0000000              0.0003132        
  2    521.4000000              0.0022396        
  3    169.0000000              0.0115966        
  4     64.0500000              0.0446575        
  5     26.7200000              0.1298826        
  6     11.8300000              0.2693947        
  7      5.3780000              0.3782728        
  8      2.4820000              0.2960663        
P   8
  1   2200.0000000             -0.0000798        
  2    521.4000000             -0.0005721        
  3    169.0000000             -0.0029722        
  4     64.0500000             -0.0115936        
  5     26.7200000             -0.0344637        
  6     11.8300000             -0.0736276        
  7      5.3780000             -0.1076276        
  8      2.4820000             -0.0875231        
P   1
  1      1.1160000              1.0000000        
P   1
  1      0.4848000              1.0000000        
P   1
  1      0.2006000              1.0000000        
P   1
  1      0.0795100              1.0000000        
D   1
  1      0.2050000              1.0000000        
D   1
  1      0.5120000              1.0000000        
D   1
  1      1.2810000              1.0000000        
D   1
  1      3.2030000              1.0000000        
F   1
  1      0.2550000              1.0000000        
F   1
  1      0.5290000              1.0000000        
F   1
  1      1.0960000              1.0000000        
G   1
  1      0.4630000              1.0000000        
G   1
  1      1.0710000              1.0000000        
H   1
  1      0.8720000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Cl
data:
CHLORINE
S   16
  1 6410000.0000000             0.0000344        
  2 959600.0000000              0.0001004        
  3 218300.0000000              0.0002758        
  4  61810.0000000              0.0007092        
  5  20140.0000000              0.0018228        
  6   7264.0000000              0.0047490        
  7   2832.0000000              0.0124754        
  8   1175.0000000              0.0319127        
  9    512.6000000              0.0760258        
 10    233.0000000              0.1600746        
 11    109.5000000              0.2750428        
 12     52.8600000              0.3319792        
 13     25.8400000              0.2150829        
 14     12.1700000              0.0450308        
 15      6.0300000             -0.0001290        
 16      3.0120000              0.0016129        
S   16
  1 6410000.0000000            -0.0000097        
  2 959600.0000000             -0.0000283        
  3 218300.0000000             -0.0000779        
  4  61810.0000000             -0.0002005        
  5  20140.0000000             -0.0005160        
  6   7264.0000000             -0.0013499        
  7   2832.0000000             -0.0035689        
  8   1175.0000000             -0.0092771        
  9    512.6000000             -0.0227920        
 10    233.0000000             -0.0513296        
 11    109.5000000             -0.1004798        
 12     52.8600000             -0.1575614        
 13     25.8400000             -0.1432679        
 14     12.1700000              0.0740429        
 15      6.0300000              0.4328062        
 16      3.0120000              0.4874777        
S   16
  1 6410000.0000000             0.0000029        
  2 959600.0000000              0.0000086        
  3 218300.0000000              0.0000236        
  4  61810.0000000              0.0000607        
  5  20140.0000000              0.0001563        
  6   7264.0000000              0.0004086        
  7   2832.0000000              0.0010824        
  8   1175.0000000              0.0028124        
  9    512.6000000              0.0069469        
 10    233.0000000              0.0156984        
 11    109.5000000              0.0312539        
 12     52.8600000              0.0500635        
 13     25.8400000              0.0480366        
 14     12.1700000             -0.0279913        
 15      6.0300000             -0.1801663        
 16      3.0120000             -0.3319244        
S   1
  1      1.5110000              1.0000000        
S   1
  1      0.6604000              1.0000000        
S   1
  1      0.2926000              1.0000000        
S   1
  1      0.1254000              1.0000000        
P   8
  1   2548.0000000              0.0003197        
  2    603.7000000              0.0022378        
  3    195.6000000              0.0115699        
  4     74.1500000              0.0446694        
  5     30.9400000              0.1308426        
  6     13.6900000              0.2733518        
  7      6.2290000              0.3832825        
  8      2.8780000              0.2909994        
P   8
  1   2548.0000000             -0.0000862        
  2    603.7000000             -0.0006038        
  3    195.6000000             -0.0031420        
  4     74.1500000             -0.0122572        
  5     30.9400000             -0.0368764        
  6     13.6900000             -0.0791535        
  7      6.2290000             -0.1172352        
  8      2.8780000             -0.0854777        
P   1
  1      1.2820000              1.0000000        
P   1
  1      0.5641000              1.0000000        
P   1
  1      0.2348000              1.0000000        
P   1
  1      0.0931200              1.0000000        
D   1
  1      0.2500000              1.0000000        
D   1
  1      0.6180000              1.0000000        
D   1
  1      1.5290000              1.0000000        
D   1
  1      3.7810000              1.0000000        
F   1
  1      0.3200000              1.0000000        
F   1
  1      0.6560000              1.0000000        
F   1
  1      1.3450000              1.0000000        
G   1
  1      0.5560000              1.0000000        
G   1
  1      1.3020000              1.0000000        
H   1
  1      1.0530000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Ar
data:
ARGON
S   16
  1 7401000.0000000             0.0000360        
  2 1108000.0000000             0.0001046        
  3 252100.0000000              0.0002853        
  4  71380.0000000              0.0007256        
  5  23260.0000000              0.0018396        
  6   8390.0000000              0.0047194        
  7   3271.0000000              0.0122482        
  8   1357.0000000              0.0311083        
  9    592.0000000              0.0740261        
 10    269.1000000              0.1562167        
 11    126.5000000              0.2708379        
 12     61.0300000              0.3325872        
 13     29.8600000              0.2214785        
 14     14.1700000              0.0491493        
 15      7.0220000              0.0000677        
 16      3.5110000              0.0016544        
S   16
  1 7401000.0000000            -0.0000103        
  2 1108000.0000000            -0.0000299        
  3 252100.0000000             -0.0000817        
  4  71380.0000000             -0.0002079        
  5  23260.0000000             -0.0005280        
  6   8390.0000000             -0.0013600        
  7   3271.0000000             -0.0035529        
  8   1357.0000000             -0.0091649        
  9    592.0000000             -0.0224864        
 10    269.1000000             -0.0506666        
 11    126.5000000             -0.0998693        
 12     61.0300000             -0.1582705        
 13     29.8600000             -0.1483667        
 14     14.1700000              0.0637359        
 15      7.0220000              0.4323161        
 16      3.5110000              0.4952230        
S   16
  1 7401000.0000000             0.0000032        
  2 1108000.0000000             0.0000094        
  3 252100.0000000              0.0000255        
  4  71380.0000000              0.0000650        
  5  23260.0000000              0.0001652        
  6   8390.0000000              0.0004252        
  7   3271.0000000              0.0011131        
  8   1357.0000000              0.0028708        
  9    592.0000000              0.0070796        
 10    269.1000000              0.0160150        
 11    126.5000000              0.0320914        
 12     61.0300000              0.0520162        
 13     29.8600000              0.0514072        
 14     14.1700000             -0.0249043        
 15      7.0220000             -0.1882269        
 16      3.5110000             -0.3495120        
S   1
  1      1.7580000              1.0000000        
S   1
  1      0.7841000              1.0000000        
S   1
  1      0.3480000              1.0000000        
S   1
  1      0.1491000              1.0000000        
P   8
  1   2927.0000000              0.0003263        
  2    693.5000000              0.0022342        
  3    224.7000000              0.0115079        
  4     85.1700000              0.0446341        
  5     35.5300000              0.1313537        
  6     15.7300000              0.2762330        
  7      7.1650000              0.3871630        
  8      3.3220000              0.2863653        
P   8
  1   2927.0000000             -0.0000913        
  2    693.5000000             -0.0006247        
  3    224.7000000             -0.0032451        
  4     85.1700000             -0.0127016        
  5     35.5300000             -0.0385234        
  6     15.7300000             -0.0831900        
  7      7.1650000             -0.1243699        
  8      3.3220000             -0.0824996        
P   1
  1      1.4780000              1.0000000        
P   1
  1      0.6552000              1.0000000        
P   1
  1      0.2751000              1.0000000        
P   1
  1      0.1097000              1.0000000        
D   1
  1      0.3090000              1.0000000        
D   1
  1      0.7700000              1.0000000        
D   1
  1      1.9170000              1.0000000        
D   1
  1      4.7760000              1.0000000        
F   1
  1      0.4080000              1.0000000        
F   1
  1      0.8250000              1.0000000        
F   1
  1      1.6680000              1.0000000        
G   1
  1      0.6650000              1.0000000        
G   1
  1      1.5620000              1.0000000        
H   1
  1      1.2640000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Sc
data:
SCANDIUM
S   27
  1      1.19495E+08            5.919535E-06     
  2      2.14992E+07            1.431359E-05     
  3      4.80703E+06            4.104556E-05     
  4      1.28440E+06            9.797419E-05     
  5 396595.0000000              0.0002223775     
  6 137575.0000000              0.0004796213     
  7  52366.8000000              0.001020521      
  8  21454.9000000              0.002175114      
  9   9316.0600000              0.004713698      
 10   4235.4000000              0.01036927       
 11   1997.4400000              0.02281143       
 12    970.4300000              0.04868009       
 13    483.2710000              0.09694442       
 14    245.8060000              0.1706005        
 15    127.3600000              0.2430080        
 16     67.0788000              0.2384914        
 17     35.8371000              0.1288846        
 18     19.3713000              0.05207441       
 19     10.5571000              0.08763543       
 20      5.7724900              0.1099903        
 21      3.1454000              0.05080978       
 22      1.6924900              0.006520852      
 23      0.8886490              0.0003956125     
 24      0.4710930             -6.181459E-05     
 25      0.2492860              1.254106E-05     
 26      0.0999880             -4.361028E-06     
 27      0.0463690              1.0567E-05       
S   27
  1      1.19495E+08           -3.393072E-06     
  2      2.14992E+07           -8.205121E-06     
  3      4.80703E+06           -2.353144E-05     
  4      1.28440E+06           -5.618118E-05     
  5 396595.0000000             -0.0001275595     
  6 137575.0000000             -0.0002752891     
  7  52366.8000000             -0.0005862466     
  8  21454.9000000             -0.001251553      
  9   9316.0600000             -0.002718589      
 10   4235.4000000             -0.006008769      
 11   1997.4400000             -0.01332407       
 12    970.4300000             -0.02890036       
 13    483.2710000             -0.05930942       
 14    245.8060000             -0.1107930        
 15    127.3600000             -0.1770984        
 16     67.0788000             -0.2162084        
 17     35.8371000             -0.1469435        
 18     19.3713000              0.0639645        
 19     10.5571000              0.3580420        
 20      5.7724900              0.4634064        
 21      3.1454000              0.2146780        
 22      1.6924900              0.02748374       
 23      0.8886490              0.0005229658     
 24      0.4710930             -0.0009373147     
 25      0.2492860             -0.0001398211     
 26      0.0999880             -1.123025E-05     
 27      0.0463690              3.671184E-05     
S   27
  1      1.19495E+08            6.682412E-07     
  2      2.14992E+07            1.616043E-06     
  3      4.80703E+06            4.635062E-06     
  4      1.28440E+06            1.106844E-05     
  5 396595.0000000              2.513795E-05     
  6 137575.0000000              5.42814E-05      
  7  52366.8000000              0.0001156787     
  8  21454.9000000              0.0002473236     
  9   9316.0600000              0.0005382997     
 10   4235.4000000              0.001194793      
 11   1997.4400000              0.002667407      
 12    970.4300000              0.005866852      
 13    483.2710000              0.01233989       
 14    245.8060000              0.02414443       
 15    127.3600000              0.04178974       
 16     67.0788000              0.05780505       
 17     35.8371000              0.04408753       
 18     19.3713000             -0.03163457       
 19     10.5571000             -0.1852648        
 20      5.7724900             -0.3507145        
 21      3.1454000             -0.2250703        
 22      1.6924900              0.2361473        
 23      0.8886490              0.5771120        
 24      0.4710930              0.3995942        
 25      0.2492860              0.08198503       
 26      0.0999880              0.003786216      
 27      0.0463690              0.00181512       
S   27
  1      1.19495E+08           -1.614274E-07     
  2      2.14992E+07           -3.903897E-07     
  3      4.80703E+06           -1.119695E-06     
  4      1.28440E+06           -2.673836E-06     
  5 396595.0000000             -6.072575E-06     
  6 137575.0000000             -1.311331E-05     
  7  52366.8000000             -2.794401E-05     
  8  21454.9000000             -5.975343E-05     
  9   9316.0600000             -0.0001300308     
 10   4235.4000000             -0.0002887116     
 11   1997.4400000             -0.0006443642     
 12    970.4300000             -0.001418217      
 13    483.2710000             -0.002982216      
 14    245.8060000             -0.005843726      
 15    127.3600000             -0.01011922       
 16     67.0788000             -0.01406049       
 17     35.8371000             -0.01073321       
 18     19.3713000              0.007697945      
 19     10.5571000              0.04671812       
 20      5.7724900              0.09236543       
 21      3.1454000              0.0606934        
 22      1.6924900             -0.07517223       
 23      0.8886490             -0.1934620        
 24      0.4710930             -0.2389696        
 25      0.2492860             -0.1062082        
 26      0.0999880              0.3515695        
 27      0.0463690              0.6241271        
S   27
  1      1.19495E+08            2.812987E-07     
  2      2.14992E+07            6.804514E-07     
  3      4.80703E+06            1.950692E-06     
  4      1.28440E+06            4.662709E-06     
  5 396595.0000000              1.056941E-05     
  6 137575.0000000              2.290727E-05     
  7  52366.8000000              4.849852E-05     
  8  21454.9000000              0.0001048147     
  9   9316.0600000              0.000224504      
 10   4235.4000000              0.0005093451     
 11   1997.4400000              0.001106294      
 12    970.4300000              0.002516249      
 13    483.2710000              0.005091015      
 14    245.8060000              0.01045914       
 15    127.3600000              0.0170637        
 16     67.0788000              0.02597877       
 17     35.8371000              0.01587703       
 18     19.3713000             -0.007290353      
 19     10.5571000             -0.09570927       
 20      5.7724900             -0.1484969        
 21      3.1454000             -0.1520052        
 22      1.6924900              0.2384846        
 23      0.8886490              0.3501435        
 24      0.4710930              0.7548168        
 25      0.2492860             -0.8094605        
 26      0.0999880             -1.4805040        
 27      0.0463690              0.7689142        
S   27
  1      1.19495E+08           -4.312322E-07     
  2      2.14992E+07           -1.043095E-06     
  3      4.80703E+06           -2.990538E-06     
  4      1.28440E+06           -7.147204E-06     
  5 396595.0000000             -1.620618E-05     
  6 137575.0000000             -3.510428E-05     
  7  52366.8000000             -7.439904E-05     
  8  21454.9000000             -0.0001605264     
  9   9316.0600000             -0.00034471       
 10   4235.4000000             -0.0007794742     
 11   1997.4400000             -0.001700679      
 12    970.4300000             -0.003848994      
 13    483.2710000             -0.007841304      
 14    245.8060000             -0.01600342       
 15    127.3600000             -0.02642693       
 16     67.0788000             -0.0397741        
 17     35.8371000             -0.02549301       
 18     19.3713000              0.0129649        
 19     10.5571000              0.1497257        
 20      5.7724900              0.2670537        
 21      3.1454000              0.2379641        
 22      1.6924900             -0.5490284        
 23      0.8886490             -1.0568440        
 24      0.4710930             -0.1164882        
 25      0.2492860              2.7444610        
 26      0.0999880             -1.4562880        
 27      0.0463690             -1.5228980        
S   27
  1      1.19495E+08           -4.876401E-07     
  2      2.14992E+07           -1.177921E-06     
  3      4.80703E+06           -3.38614E-06      
  4      1.28440E+06           -8.050139E-06     
  5 396595.0000000             -1.844652E-05     
  6 137575.0000000             -3.916005E-05     
  7  52366.8000000             -8.601642E-05     
  8  21454.9000000             -0.0001749806     
  9   9316.0600000             -0.0004098121     
 10   4235.4000000             -0.000822644      
 11   1997.4400000             -0.002082943      
 12    970.4300000             -0.003935527      
 13    483.2710000             -0.009907611      
 14    245.8060000             -0.01561908       
 15    127.3600000             -0.03578066       
 16     67.0788000             -0.0322496        
 17     35.8371000             -0.05745036       
 18     19.3713000              0.06918013       
 19     10.5571000              0.06434433       
 20      5.7724900              0.5933674        
 21      3.1454000             -0.1545044        
 22      1.6924900             -0.3050918        
 23      0.8886490             -2.9817180        
 24      0.4710930              4.9770390        
 25      0.2492860             -1.0825320        
 26      0.0999880             -4.2115770        
 27      0.0463690              5.6433950        
S   27
  1      1.19495E+08            7.519349E-07     
  2      2.14992E+07            1.820755E-06     
  3      4.80703E+06            5.209344E-06     
  4      1.28440E+06            1.250064E-05     
  5 396595.0000000              2.812046E-05     
  6 137575.0000000              6.183087E-05     
  7  52366.8000000              0.0001276431     
  8  21454.9000000              0.0002872        
  9   9316.0600000              0.0005798599     
 10   4235.4000000              0.001423352      
 11   1997.4400000              0.002800518      
 12    970.4300000              0.007178441      
 13    483.2710000              0.01264813       
 14    245.8060000              0.03086293       
 15    127.3600000              0.04074745       
 16     67.0788000              0.08547422       
 17     35.8371000              0.01756683       
 18     19.3713000              0.03153591       
 19     10.5571000             -0.4357717        
 20      5.7724900             -0.5492452        
 21      3.1454000             -0.4585412        
 22      1.6924900              4.1915080        
 23      0.8886490             -2.5292380        
 24      0.4710930             -5.4200720        
 25      0.2492860              9.3856740        
 26      0.0999880             -8.5529250        
 27      0.0463690              6.2316380        
S   1
  1      0.0216060              1.0000000        
P   19
  1  55070.5000000              0.0000140        
  2  13741.7000000              0.0000480        
  3   4365.4000000              0.0002020        
  4   1642.2600000              0.0007550        
  5    694.0660000              0.0026780        
  6    317.7420000              0.0085560        
  7    153.8990000              0.0245140        
  8     77.7665000              0.0617000        
  9     40.6736000              0.1309760        
 10     21.9061000              0.2216990        
 11     12.0795000              0.2929820        
 12      6.7534900              0.2755820        
 13      3.7632100              0.1467940        
 14      2.0497300              0.0316730        
 15      1.0864500              0.0001230        
 16      0.5640870             -0.0016080        
 17      0.2810200             -0.0008200        
 18      0.1214320             -0.0000640        
 19      0.0533450             -0.0000110        
P   19
  1  55070.5000000             -0.0000050        
  2  13741.7000000             -0.0000160        
  3   4365.4000000             -0.0000660        
  4   1642.2600000             -0.0002480        
  5    694.0660000             -0.0008820        
  6    317.7420000             -0.0028300        
  7    153.8990000             -0.0081890        
  8     77.7665000             -0.0209720        
  9     40.6736000             -0.0457600        
 10     21.9061000             -0.0797890        
 11     12.0795000             -0.1104030        
 12      6.7534900             -0.1073290        
 13      3.7632100              0.0005330        
 14      2.0497300              0.2185950        
 15      1.0864500              0.3923630        
 16      0.5640870              0.3629300        
 17      0.2810200              0.1490230        
 18      0.1214320              0.0150900        
 19      0.0533450              0.0005720        
P   19
  1  55070.5000000             -0.0000010        
  2  13741.7000000             -0.0000040        
  3   4365.4000000             -0.0000160        
  4   1642.2600000             -0.0000600        
  5    694.0660000             -0.0002160        
  6    317.7420000             -0.0006880        
  7    153.8990000             -0.0020050        
  8     77.7665000             -0.0051070        
  9     40.6736000             -0.0112560        
 10     21.9061000             -0.0194870        
 11     12.0795000             -0.0275520        
 12      6.7534900             -0.0261990        
 13      3.7632100              0.0018280        
 14      2.0497300              0.0650400        
 15      1.0864500              0.1153720        
 16      0.5640870              0.1375210        
 17      0.2810200             -0.0077520        
 18      0.1214320             -0.3617510        
 19      0.0533450             -0.5419820        
P   19
  1  55070.5000000              0.0000010        
  2  13741.7000000              0.0000050        
  3   4365.4000000              0.0000200        
  4   1642.2600000              0.0000740        
  5    694.0660000              0.0002620        
  6    317.7420000              0.0008430        
  7    153.8990000              0.0024310        
  8     77.7665000              0.0062550        
  9     40.6736000              0.0136160        
 10     21.9061000              0.0239330        
 11     12.0795000              0.0330500        
 12      6.7534900              0.0328270        
 13      3.7632100             -0.0025620        
 14      2.0497300             -0.0748050        
 15      1.0864500             -0.1376450        
 16      0.5640870             -0.1704280        
 17      0.2810200             -0.0478640        
 18      0.1214320              0.5835210        
 19      0.0533450              0.5151680        
P   19
  1  55070.5000000              0.0000030        
  2  13741.7000000              0.0000090        
  3   4365.4000000              0.0000410        
  4   1642.2600000              0.0001420        
  5    694.0660000              0.0005460        
  6    317.7420000              0.0016140        
  7    153.8990000              0.0050860        
  8     77.7665000              0.0118990        
  9     40.6736000              0.0287890        
 10     21.9061000              0.0441380        
 11     12.0795000              0.0761020        
 12      6.7534900              0.0560570        
 13      3.7632100              0.0243250        
 14      2.0497300             -0.2171150        
 15      1.0864500             -0.3703350        
 16      0.5640870             -0.4435200        
 17      0.2810200              1.2379380        
 18      0.1214320              0.4129960        
 19      0.0533450             -0.9400080        
P   19
  1  55070.5000000             -0.0000030        
  2  13741.7000000             -0.0000120        
  3   4365.4000000             -0.0000410        
  4   1642.2600000             -0.0002080        
  5    694.0660000             -0.0005200        
  6    317.7420000             -0.0024110        
  7    153.8990000             -0.0047120        
  8     77.7665000             -0.0181750        
  9     40.6736000             -0.0243790        
 10     21.9061000             -0.0766640        
 11     12.0795000             -0.0436370        
 12      6.7534900             -0.1925250        
 13      3.7632100              0.1326390        
 14      2.0497300              0.1135500        
 15      1.0864500              1.3669040        
 16      0.5640870             -1.5617250        
 17      0.2810200             -0.8936100        
 18      0.1214320              2.2910790        
 19      0.0533450             -1.2338460        
P   19
  1  55070.5000000             -0.0000050        
  2  13741.7000000             -0.0000160        
  3   4365.4000000             -0.0000700        
  4   1642.2600000             -0.0002610        
  5    694.0660000             -0.0009290        
  6    317.7420000             -0.0029870        
  7    153.8990000             -0.0086890        
  8     77.7665000             -0.0225240        
  9     40.6736000             -0.0494670        
 10     21.9061000             -0.0860160        
 11     12.0795000             -0.1162080        
 12      6.7534900             -0.1761440        
 13      3.7632100              0.0102780        
 14      2.0497300              1.2619260        
 15      1.0864500              0.2599850        
 16      0.5640870             -3.7739520        
 17      0.2810200              4.5043640        
 18      0.1214320             -2.6297080        
 19      0.0533450              0.5247230        
P   1
  1      0.0231430              1.0000000        
D   11
  1    206.8490000              0.0002450        
  2     60.9977000              0.0021780        
  3     23.3085000              0.0108150        
  4      9.9288100              0.0355520        
  5      4.4867000              0.0918530        
  6      2.1263200              0.1773870        
  7      1.0200800              0.2535140        
  8      0.4853730              0.2911880        
  9      0.2271980              0.2739590        
 10      0.1042040              0.1939380        
 11      0.0468350              0.0750160        
D   11
  1    206.8490000             -0.0002520        
  2     60.9977000             -0.0022360        
  3     23.3085000             -0.0111280        
  4      9.9288100             -0.0368300        
  5      4.4867000             -0.0965200        
  6      2.1263200             -0.1818110        
  7      1.0200800             -0.2453530        
  8      0.4853730             -0.2113190        
  9      0.2271980              0.0933260        
 10      0.1042040              0.4634600        
 11      0.0468350              0.3871780        
D   11
  1    206.8490000             -0.0003270        
  2     60.9977000             -0.0028490        
  3     23.3085000             -0.0145650        
  4      9.9288100             -0.0472320        
  5      4.4867000             -0.1264930        
  6      2.1263200             -0.2349220        
  7      1.0200800             -0.2844630        
  8      0.4853730              0.0738220        
  9      0.2271980              0.7433150        
 10      0.1042040              0.1237380        
 11      0.0468350             -0.6748410        
D   11
  1    206.8490000             -0.0004720        
  2     60.9977000             -0.0038040        
  3     23.3085000             -0.0209510        
  4      9.9288100             -0.0644210        
  5      4.4867000             -0.1927550        
  6      2.1263200             -0.3074170        
  7      1.0200800             -0.2835280        
  8      0.4853730              1.0750720        
  9      0.2271980              0.0383790        
 10      0.1042040             -1.2564750        
 11      0.0468350              0.7662620        
D   11
  1    206.8490000             -0.0005390        
  2     60.9977000             -0.0068390        
  3     23.3085000             -0.0259800        
  4      9.9288100             -0.1209740        
  5      4.4867000             -0.2394840        
  6      2.1263200             -0.6282700        
  7      1.0200800              0.9521130        
  8      0.4853730              0.6713530        
  9      0.2271980             -2.1441440        
 10      0.1042040              1.9275440        
 11      0.0468350             -0.6275630        
D   1
  1      0.0202590              1.0000000        
F   1
  1      2.3108000              1.0000000        
F   1
  1      0.7560000              1.0000000        
F   1
  1      0.2473000              1.0000000        
F   1
  1      0.0809000              1.0000000        
G   1
  1      1.7350000              1.0000000        
G   1
  1      0.5448000              1.0000000        
G   1
  1      0.1711000              1.0000000        
H   1
  1      1.1423000              1.0000000        
H   1
  1      0.3290000              1.0000000        
I   1
  1      1.1682000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Ti
data:
TITANIUM
S   27
  1      1.22647E+08            6.653555E-06     
  2      2.19562E+07            1.613946E-05     
  3      4.90233E+06            4.614898E-05     
  4      1.31060E+06            0.0001098321     
  5 405228.0000000              0.0002484956     
  6 140757.0000000              0.0005342847     
  7  53625.1000000              0.001133562      
  8  21976.2000000              0.0024093        
  9   9539.6000000              0.005206248      
 10   4334.3700000              0.01141582       
 11   2042.8900000              0.02500563       
 12    992.3080000              0.05299834       
 13    494.4460000              0.1043003        
 14    251.9070000              0.1799215        
 15    130.9050000              0.2478886        
 16     69.2368000              0.2308955        
 17     37.1847000              0.1171295        
 18     20.2157000              0.05130277       
 19     11.0765000              0.09090767       
 20      6.0786700              0.1038986        
 21      3.3127700              0.04277212       
 22      1.7725000              0.004698514      
 23      0.9173780              0.0002635682     
 24      0.4692830             -6.454181E-05     
 25      0.2192670              1.082874E-05     
 26      0.1058110              8.421612E-08     
 27      0.0484430              1.563308E-05     
S   27
  1      1.22647E+08           -3.777645E-06     
  2      2.19562E+07           -9.164102E-06     
  3      4.90233E+06           -2.620684E-05     
  4      1.31060E+06           -6.238605E-05     
  5 405228.0000000             -0.0001412011     
  6 140757.0000000             -0.0003037954     
  7  53625.1000000             -0.0006451652     
  8  21976.2000000             -0.001373651      
  9   9539.6000000             -0.002976146      
 10   4334.3700000             -0.006559216      
 11   2042.8900000             -0.01449461       
 12    992.3080000             -0.03126791       
 13    494.4460000             -0.06359677       
 14    251.9070000             -0.1170675        
 15    130.9050000             -0.1828196        
 16     69.2368000             -0.2142700        
 17     37.1847000             -0.1312221        
 18     20.2157000              0.09218944       
 19     11.0765000              0.3859538        
 20      6.0786700              0.4515632        
 21      3.3127700              0.1862977        
 22      1.7725000              0.02023129       
 23      0.9173780             -6.633534E-05     
 24      0.4692830             -0.0008927498     
 25      0.2192670             -6.197787E-05     
 26      0.1058110              1.790704E-05     
 27      0.0484430              5.846808E-05     
S   27
  1      1.22647E+08            7.674459E-07     
  2      2.19562E+07            1.861863E-06     
  3      4.90233E+06            5.324913E-06     
  4      1.31060E+06            1.2679E-05       
  5 405228.0000000              2.870495E-05     
  6 140757.0000000              6.179898E-05     
  7  53625.1000000              0.0001313324     
  8  21976.2000000              0.000280105      
  9   9539.6000000              0.0006080523     
 10   4334.3700000              0.001346488      
 11   2042.8900000              0.002996038      
 12    992.3080000              0.006562148      
 13    494.4460000              0.01369205       
 14    251.9070000              0.02648196       
 15    130.9050000              0.0448890        
 16     69.2368000              0.05976643       
 17     37.1847000              0.04031555       
 18     20.2157000             -0.0441235        
 19     11.0765000             -0.2114728        
 20      6.0786700             -0.3640708        
 21      3.3127700             -0.1847230        
 22      1.7725000              0.3081164        
 23      0.9173780              0.6066013        
 24      0.4692830              0.3468082        
 25      0.2192670              0.04058903       
 26      0.1058110             -0.000391043      
 27      0.0484430              0.002501968      
S   27
  1      1.22647E+08           -1.819398E-07     
  2      2.19562E+07           -4.41398E-07      
  3      4.90233E+06           -1.262383E-06     
  4      1.31060E+06           -3.005895E-06     
  5 405228.0000000             -6.805029E-06     
  6 140757.0000000             -1.465182E-05     
  7  53625.1000000             -3.113348E-05     
  8  21976.2000000             -6.641746E-05     
  9   9539.6000000             -0.0001441365     
 10   4334.3700000             -0.000319341      
 11   2042.8900000             -0.0007102401     
 12    992.3080000             -0.001557001      
 13    494.4460000             -0.003247483      
 14    251.9070000             -0.006292418      
 15    130.9050000             -0.01067067       
 16     69.2368000             -0.01428281       
 17     37.1847000             -0.009632094      
 18     20.2157000              0.0105720        
 19     11.0765000              0.05267722       
 20      6.0786700              0.09469896       
 21      3.3127700              0.04838713       
 22      1.7725000             -0.09536682       
 23      0.9173780             -0.2116255        
 24      0.4692830             -0.2381936        
 25      0.2192670             -0.05246589       
 26      0.1058110              0.3869866        
 27      0.0484430              0.6037621        
S   27
  1      1.22647E+08            3.399465E-07     
  2      2.19562E+07            8.247278E-07     
  3      4.90233E+06            2.358728E-06     
  4      1.31060E+06            5.616301E-06     
  5 405228.0000000              1.271542E-05     
  6 140757.0000000              2.737492E-05     
  7  53625.1000000              5.817942E-05     
  8  21976.2000000              0.0001240819     
  9   9539.6000000              0.0002693998     
 10   4334.3700000              0.000596555      
 11   2042.8900000              0.001327899      
 12    992.3080000              0.00290901       
 13    494.4460000              0.006076074      
 14    251.9070000              0.01176603       
 15    130.9050000              0.02001317       
 16     69.2368000              0.02677974       
 17     37.1847000              0.01826065       
 18     20.2157000             -0.02007811       
 19     11.0765000             -0.1014260        
 20      6.0786700             -0.1911626        
 21      3.3127700             -0.09195848       
 22      1.7725000              0.2382647        
 23      0.9173780              0.5877260        
 24      0.4692830              0.3656232        
 25      0.2192670             -0.9952926        
 26      0.1058110             -1.0629930        
 27      0.0484430              0.7767954        
S   27
  1      1.22647E+08           -5.165097E-07     
  2      2.19562E+07           -1.252882E-06     
  3      4.90233E+06           -3.58436E-06      
  4      1.31060E+06           -8.529531E-06     
  5 405228.0000000             -1.933437E-05     
  6 140757.0000000             -4.152977E-05     
  7  53625.1000000             -8.86271E-05      
  8  21976.2000000             -0.0001877584     
  9   9539.6000000             -0.0004117762     
 10   4334.3700000             -0.0008995392     
 11   2042.8900000             -0.00203764       
 12    992.3080000             -0.004372593      
 13    494.4460000             -0.009371418      
 14    251.9070000             -0.01761793       
 15    130.9050000             -0.03127669       
 16     69.2368000             -0.0394600        
 17     37.1847000             -0.03164837       
 18     20.2157000              0.03808886       
 19     11.0765000              0.1502097        
 20      6.0786700              0.3568484        
 21      3.3127700              0.09579577       
 22      1.7725000             -0.5931501        
 23      0.9173780             -1.4029870        
 24      0.4692830              1.2948550        
 25      0.2192670              2.1050350        
 26      0.1058110             -2.3454890        
 27      0.0484430             -0.6659030        
S   27
  1      1.22647E+08           -6.130654E-07     
  2      2.19562E+07           -1.486934E-06     
  3      4.90233E+06           -4.254847E-06     
  4      1.31060E+06           -1.0121E-05       
  5 405228.0000000             -2.296105E-05     
  6 140757.0000000             -4.924078E-05     
  7  53625.1000000             -0.0001053951     
  8  21976.2000000             -0.0002221924     
  9   9539.6000000             -0.0004909744     
 10   4334.3700000             -0.001061652      
 11   2042.8900000             -0.002437073      
 12    992.3080000             -0.005148493      
 13    494.4460000             -0.01125485       
 14    251.9070000             -0.02070111       
 15    130.9050000             -0.03801176       
 16     69.2368000             -0.0460026        
 17     37.1847000             -0.04154012       
 18     20.2157000              0.0487637        
 19     11.0765000              0.1925955        
 20      6.0786700              0.5435896        
 21      3.3127700             -0.05407633       
 22      1.7725000             -1.3033880        
 23      0.9173780             -1.3684980        
 24      0.4692830              4.8530280        
 25      0.2192670             -3.2762980        
 26      0.1058110             -1.5668410        
 27      0.0484430              4.2040350        
S   27
  1      1.22647E+08           -8.549962E-07     
  2      2.19562E+07           -2.079199E-06     
  3      4.90233E+06           -5.919144E-06     
  4      1.31060E+06           -1.422274E-05     
  5 405228.0000000             -3.162293E-05     
  6 140757.0000000             -7.045952E-05     
  7  53625.1000000             -0.0001407958     
  8  21976.2000000             -0.0003314919     
  9   9539.6000000             -0.0006194799     
 10   4334.3700000             -0.001674815      
 11   2042.8900000             -0.002880831      
 12    992.3080000             -0.008576546      
 13    494.4460000             -0.01234665       
 14    251.9070000             -0.03746245       
 15    130.9050000             -0.03433454       
 16     69.2368000             -0.1097497        
 17     37.1847000              0.03447519       
 18     20.2157000             -0.1133770        
 19     11.0765000              0.6927722        
 20      6.0786700              0.3005719        
 21      3.3127700              0.4990677        
 22      1.7725000             -5.4080910        
 23      0.9173780              7.0117810        
 24      0.4692830             -1.6041680        
 25      0.2192670             -5.4763320        
 26      0.1058110              8.3958070        
 27      0.0484430             -6.4227320        
S   1
  1      0.0225350              1.0000000        
P   19
  1  59284.9000000              0.0000160        
  2  14323.6000000              0.0000550        
  3   4537.2200000              0.0002280        
  4   1726.5400000              0.0008230        
  5    741.0750000              0.0028250        
  6    343.8070000              0.0088340        
  7    167.8840000              0.0251330        
  8     85.0394000              0.0634540        
  9     44.3829000              0.1354900        
 10     23.7928000              0.2297170        
 11     13.0536000              0.3000430        
 12      7.2687200              0.2708810        
 13      4.0380500              0.1339910        
 14      2.1929400              0.0256630        
 15      1.1616200             -0.0004750        
 16      0.6032500             -0.0015650        
 17      0.3001740             -0.0006970        
 18      0.1301310             -0.0000450        
 19      0.0572230             -0.0000100        
P   19
  1  59284.9000000             -0.0000050        
  2  14323.6000000             -0.0000180        
  3   4537.2200000             -0.0000760        
  4   1726.5400000             -0.0002760        
  5    741.0750000             -0.0009510        
  6    343.8070000             -0.0029880        
  7    167.8840000             -0.0085890        
  8     85.0394000             -0.0220780        
  9     44.3829000             -0.0485130        
 10     23.7928000             -0.0848740        
 11     13.0536000             -0.1165050        
 12      7.2687200             -0.1060460        
 13      4.0380500              0.0208230        
 14      2.1929400              0.2474250        
 15      1.1616200              0.4015100        
 16      0.6032500              0.3401570        
 17      0.3001740              0.1258060        
 18      0.1301310              0.0112720        
 19      0.0572230              0.0006720        
P   19
  1  59284.9000000              0.0000010        
  2  14323.6000000              0.0000040        
  3   4537.2200000              0.0000180        
  4   1726.5400000              0.0000660        
  5    741.0750000              0.0002290        
  6    343.8070000              0.0007140        
  7    167.8840000              0.0020690        
  8     85.0394000              0.0052890        
  9     44.3829000              0.0117380        
 10     23.7928000              0.0203950        
 11     13.0536000              0.0286140        
 12      7.2687200              0.0253940        
 13      4.0380500             -0.0070940        
 14      2.1929400             -0.0720970        
 15      1.1616200             -0.1181340        
 16      0.6032500             -0.1292760        
 17      0.3001740              0.0315740        
 18      0.1301310              0.3785710        
 19      0.0572230              0.5269710        
P   19
  1  59284.9000000              0.0000020        
  2  14323.6000000              0.0000060        
  3   4537.2200000              0.0000230        
  4   1726.5400000              0.0000830        
  5    741.0750000              0.0002880        
  6    343.8070000              0.0008990        
  7    167.8840000              0.0026000        
  8     85.0394000              0.0066510        
  9     44.3829000              0.0147430        
 10     23.7928000              0.0256560        
 11     13.0536000              0.0359060        
 12      7.2687200              0.0320880        
 13      4.0380500             -0.0081700        
 14      2.1929400             -0.0887810        
 15      1.1616200             -0.1438960        
 16      0.6032500             -0.1737260        
 17      0.3001740              0.0151180        
 18      0.1301310              0.6060130        
 19      0.0572230              0.4639250        
P   19
  1  59284.9000000              0.0000030        
  2  14323.6000000              0.0000110        
  3   4537.2200000              0.0000460        
  4   1726.5400000              0.0001590        
  5    741.0750000              0.0005830        
  6    343.8070000              0.0017100        
  7    167.8840000              0.0052750        
  8     85.0394000              0.0126190        
  9     44.3829000              0.0300870        
 10     23.7928000              0.0478170        
 11     13.0536000              0.0780840        
 12      7.2687200              0.0572690        
 13      4.0380500              0.0042350        
 14      2.1929400             -0.2405920        
 15      1.1616200             -0.3988240        
 16      0.6032500             -0.3071790        
 17      0.3001740              1.2623310        
 18      0.1301310              0.2556860        
 19      0.0572230             -0.8992420        
P   19
  1  59284.9000000              0.0000040        
  2  14323.6000000              0.0000150        
  3   4537.2200000              0.0000510        
  4   1726.5400000              0.0002320        
  5    741.0750000              0.0006090        
  6    343.8070000              0.0025490        
  7    167.8840000              0.0054260        
  8     85.0394000              0.0189510        
  9     44.3829000              0.0294070        
 10     23.7928000              0.0786330        
 11     13.0536000              0.0601470        
 12      7.2687200              0.1842020        
 13      4.0380500             -0.1207450        
 14      2.1929400             -0.3032660        
 15      1.1616200             -1.2402470        
 16      0.6032500              1.9464230        
 17      0.3001740              0.3010090        
 18      0.1301310             -1.9812890        
 19      0.0572230              1.1972360        
P   19
  1  59284.9000000             -0.0000060        
  2  14323.6000000             -0.0000180        
  3   4537.2200000             -0.0000810        
  4   1726.5400000             -0.0002690        
  5    741.0750000             -0.0010210        
  6    343.8070000             -0.0028930        
  7    167.8840000             -0.0093000        
  8     85.0394000             -0.0215640        
  9     44.3829000             -0.0538970        
 10     23.7928000             -0.0809110        
 11     13.0536000             -0.1385590        
 12      7.2687200             -0.1746190        
 13      4.0380500              0.0897820        
 14      2.1929400              1.4800170        
 15      1.1616200             -0.5900780        
 16      0.6032500             -2.8885950        
 17      0.3001740              4.2554030        
 18      0.1301310             -2.8758510        
 19      0.0572230              0.8101380        
P   1
  1      0.0249100              1.0000000        
D   11
  1    261.2460000              0.0002210        
  2     77.4454000              0.0019730        
  3     29.6879000              0.0101400        
  4     12.7642000              0.0343140        
  5      5.8299200              0.0898200        
  6      2.7978300              0.1779610        
  7      1.3638300              0.2593050        
  8      0.6600370              0.2967420        
  9      0.3136990              0.2697420        
 10      0.1449780              0.1799180        
 11      0.0647720              0.0669950        
D   11
  1    261.2460000             -0.0002250        
  2     77.4454000             -0.0020120        
  3     29.6879000             -0.0103650        
  4     12.7642000             -0.0353510        
  5      5.8299200             -0.0943990        
  6      2.7978300             -0.1831950        
  7      1.3638300             -0.2438690        
  8      0.6600370             -0.1915460        
  9      0.3136990              0.1086070        
 10      0.1449780              0.4574300        
 11      0.0647720              0.3913590        
D   11
  1    261.2460000             -0.0003590        
  2     77.4454000             -0.0031940        
  3     29.6879000             -0.0167290        
  4     12.7642000             -0.0574460        
  5      5.8299200             -0.1579450        
  6      2.7978300             -0.2878870        
  7      1.3638300             -0.2743220        
  8      0.6600370              0.1968330        
  9      0.3136990              0.6962870        
 10      0.1449780              0.0262030        
 11      0.0647720             -0.6014690        
D   11
  1    261.2460000              0.0004330        
  2     77.4454000              0.0036220        
  3     29.6879000              0.0201220        
  4     12.7642000              0.0664280        
  5      5.8299200              0.2041410        
  6      2.7978300              0.3220550        
  7      1.3638300              0.1271500        
  8      0.6600370             -0.9939100        
  9      0.3136990              0.0726930        
 10      0.1449780              1.1603820        
 11      0.0647720             -0.6995170        
D   11
  1    261.2460000              0.0005540        
  2     77.4454000              0.0061940        
  3     29.6879000              0.0274000        
  4     12.7642000              0.1196640        
  5      5.8299200              0.2918240        
  6      2.7978300              0.5157480        
  7      1.3638300             -0.9398630        
  8      0.6600370             -0.5732200        
  9      0.3136990              1.9949630        
 10      0.1449780             -1.6489450        
 11      0.0647720              0.2848740        
D   1
  1      0.0273760              1.0000000        
F   1
  1      3.5042000              1.0000000        
F   1
  1      1.1617000              1.0000000        
F   1
  1      0.3851000              1.0000000        
F   1
  1      0.1277000              1.0000000        
G   1
  1      2.5324000              1.0000000        
G   1
  1      0.8027000              1.0000000        
G   1
  1      0.2544000              1.0000000        
H   1
  1      1.8034000              1.0000000        
H   1
  1      0.5044000              1.0000000        
I   1
  1      0.9864000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: V
data:
VANADIUM
S   27
  1      1.28349E+08            7.356705E-06     
  2      2.29044E+07            1.786824E-05     
  3      5.10777E+06            5.098889E-05     
  4      1.36528E+06            0.000121072      
  5 422228.0000000              0.0002732114     
  6 146685.0000000              0.0005857547     
  7  55872.3000000              0.001239105      
  8  22881.3000000              0.002625599      
  9   9920.4500000              0.00565687       
 10   4499.9200000              0.01237143       
 11   2116.7500000              0.02703115       
 12   1026.0600000              0.05709522       
 13    510.2570000              0.1115932        
 14    259.5320000              0.1898393        
 15    134.7090000              0.2543687        
 16     71.2104000              0.2252741        
 17     38.2496000              0.1067044        
 18     20.8102000              0.0511901        
 19     11.4158000              0.09230865       
 20      6.2730200              0.09330965       
 21      3.4217700              0.03315559       
 22      1.8304400              0.003087216      
 23      0.9452350              0.0001488484     
 24      0.4759280             -5.731104E-05     
 25      0.1863810              5.722118E-06     
 26      0.1067680              7.095741E-06     
 27      0.0499790              1.841164E-05     
S   27
  1      1.28349E+08           -4.077497E-06     
  2      2.29044E+07           -9.904408E-06     
  3      5.10777E+06           -2.826701E-05     
  4      1.36528E+06           -6.713697E-05     
  5 422228.0000000             -0.0001515645     
  6 146685.0000000             -0.00032518       
  7  55872.3000000             -0.0006886285     
  8  22881.3000000             -0.00146189       
  9   9920.4500000             -0.00315893       
 10   4499.9200000             -0.006946262      
 11   2116.7500000             -0.01532505       
 12   1026.0600000             -0.03299103       
 13    510.2570000             -0.06684496       
 14    259.5320000             -0.1220202        
 15    134.7090000             -0.1873822        
 16     71.2104000             -0.2113255        
 17     38.2496000             -0.1130379        
 18     20.8102000              0.1277586        
 19     11.4158000              0.4186041        
 20      6.2730200              0.4309142        
 21      3.4217700              0.1532117        
 22      1.8304400              0.0139112        
 23      0.9452350             -0.0005845882     
 24      0.4759280             -0.0007972901     
 25      0.1863810             -5.538211E-05     
 26      0.1067680              6.572664E-05     
 27      0.0499790              7.19369E-05      
S   27
  1      1.28349E+08            8.603915E-07     
  2      2.29044E+07            2.090087E-06     
  3      5.10777E+06            5.965628E-06     
  4      1.36528E+06            1.417245E-05     
  5 422228.0000000              3.200385E-05     
  6 146685.0000000              6.871208E-05     
  7  55872.3000000              0.0001456091     
  8  22881.3000000              0.0003096893     
  9   9920.4500000              0.0006704643     
 10   4499.9200000              0.001481838      
 11   2116.7500000              0.003291939      
 12   1026.0600000              0.007201054      
 13    510.2570000              0.01497543       
 14    259.5320000              0.0287821        
 15    134.7090000              0.04804314       
 16     71.2104000              0.06159329       
 17     38.2496000              0.03536191       
 18     20.8102000             -0.06073828       
 19     11.4158000             -0.2436103        
 20      6.2730200             -0.3702706        
 21      3.4217700             -0.1271151        
 22      1.8304400              0.3751019        
 23      0.9452350              0.6053597        
 24      0.4759280              0.2921984        
 25      0.1863810              0.02433509       
 26      0.1067680             -0.004127538      
 27      0.0499790              0.003018388      
S   27
  1      1.28349E+08           -2.00208E-07      
  2      2.29044E+07           -4.863529E-07     
  3      5.10777E+06           -1.388165E-06     
  4      1.36528E+06           -3.297899E-06     
  5 422228.0000000             -7.447067E-06     
  6 146685.0000000             -1.59897E-05      
  7  55872.3000000             -3.388204E-05     
  8  22881.3000000             -7.20715E-05      
  9   9920.4500000             -0.0001560162     
 10   4499.9200000             -0.0003449014     
 11   2116.7500000             -0.0007661694     
 12   1026.0600000             -0.00167669       
 13    510.2570000             -0.003487904      
 14    259.5320000             -0.006711267      
 15    134.7090000             -0.0112217        
 16     71.2104000             -0.01444379       
 17     38.2496000             -0.00833094       
 18     20.8102000              0.0144271        
 19     11.4158000              0.05982672       
 20      6.2730200              0.09540397       
 21      3.4217700              0.03117879       
 22      1.8304400             -0.1132242        
 23      0.9452350             -0.2210081        
 24      0.4759280             -0.2196576        
 25      0.1863810              0.0003626926     
 26      0.1067680              0.4068028        
 27      0.0499790              0.5697882        
S   27
  1      1.28349E+08           -3.901614E-07     
  2      2.29044E+07           -9.475826E-07     
  3      5.10777E+06           -2.70579E-06      
  4      1.36528E+06           -6.422846E-06     
  5 422228.0000000             -1.452788E-05     
  6 146685.0000000             -3.109393E-05     
  7  55872.3000000             -6.626421E-05     
  8  22881.3000000             -0.0001396479     
  9   9920.4500000             -0.0003065372     
 10   4499.9200000             -0.000664949      
 11   2116.7500000             -0.00151327       
 12   1026.0600000             -0.003216756      
 13    510.2570000             -0.006933933      
 14    259.5320000             -0.01278132       
 15    134.7090000             -0.02268481       
 16     71.2104000             -0.02661842       
 17     38.2496000             -0.02007282       
 18     20.8102000              0.03592281       
 19     11.4158000              0.1069343        
 20      6.2730200              0.2278498        
 21      3.4217700              0.01379761       
 22      1.8304400             -0.2372538        
 23      0.9452350             -0.7484825        
 24      0.4759280              0.02202189       
 25      0.1863810              1.2833500        
 26      0.1067680              0.4625684        
 27      0.0499790             -0.7206233        
S   27
  1      1.28349E+08           -5.943749E-07     
  2      2.29044E+07           -1.443354E-06     
  3      5.10777E+06           -4.122573E-06     
  4      1.36528E+06           -9.780822E-06     
  5 422228.0000000             -2.214671E-05     
  6 146685.0000000             -4.730618E-05     
  7  55872.3000000             -0.0001011766     
  8  22881.3000000             -0.000211986      
  9   9920.4500000             -0.0004694133     
 10   4499.9200000             -0.001006324      
 11   2116.7500000             -0.00232522       
 12   1026.0600000             -0.004855172      
 13    510.2570000             -0.01070394       
 14    259.5320000             -0.01923086       
 15    134.7090000             -0.03545813       
 16     71.2104000             -0.03942564       
 17     38.2496000             -0.03445506       
 18     20.8102000              0.06260601       
 19     11.4158000              0.1646280        
 20      6.2730200              0.4190186        
 21      3.4217700             -0.05135443       
 22      1.8304400             -0.6890882        
 23      0.9452350             -1.4265880        
 24      0.4759280              2.1578180        
 25      0.1863810              1.5272650        
 26      0.1067680             -2.8478340        
 27      0.0499790             -0.04977937       
S   27
  1      1.28349E+08           -7.289808E-07     
  2      2.29044E+07           -1.771972E-06     
  3      5.10777E+06           -5.05166E-06      
  4      1.36528E+06           -1.202932E-05     
  5 422228.0000000             -2.704018E-05     
  6 146685.0000000             -5.856786E-05     
  7  55872.3000000             -0.0001222068     
  8  22881.3000000             -0.0002665839     
  9   9920.4500000             -0.0005559679     
 10   4499.9200000             -0.001293282      
 11   2116.7500000             -0.002695009      
 12   1026.0600000             -0.006381528      
 13    510.2570000             -0.01210982       
 14    259.5320000             -0.02625689       
 15    134.7090000             -0.03787767       
 16     71.2104000             -0.06283789       
 17     38.2496000             -0.01409767       
 18     20.8102000              0.01527717       
 19     11.4158000              0.3657945        
 20      6.2730200              0.4139635        
 21      3.4217700              0.003465761      
 22      1.8304400             -2.1710400        
 23      0.9452350              0.5191237        
 24      0.4759280              3.3917220        
 25      0.1863810             -4.9828040        
 26      0.1067680              1.6527780        
 27      0.0499790              2.6936830        
S   27
  1      1.28349E+08           -9.534105E-07     
  2      2.29044E+07           -2.320734E-06     
  3      5.10777E+06           -6.598483E-06     
  4      1.36528E+06           -1.579531E-05     
  5 422228.0000000             -3.513656E-05     
  6 146685.0000000             -7.763263E-05     
  7  55872.3000000             -0.0001562748     
  8  22881.3000000             -0.0003611841     
  9   9920.4500000             -0.0006895381     
 10   4499.9200000             -0.001804534      
 11   2116.7500000             -0.003226883      
 12   1026.0600000             -0.009168809      
 13    510.2570000             -0.01391968       
 14    259.5320000             -0.03951576       
 15    134.7090000             -0.03886446       
 16     71.2104000             -0.1101614        
 17     38.2496000              0.03633212       
 18     20.8102000             -0.08353228       
 19     11.4158000              0.7752076        
 20      6.2730200              0.3636147        
 21      3.4217700             -0.2488450        
 22      1.8304400             -4.9880880        
 23      0.9452350              8.8278190        
 24      0.4759280             -5.6118930        
 25      0.1863810             -1.7489600        
 26      0.1067680              6.6204950        
 27      0.0499790             -6.0660540        
S   1
  1      0.0235010              1.0000000        
P   19
  1  67602.1000000              0.0000170        
  2  16330.1000000              0.0000560        
  3   5149.5900000              0.0002280        
  4   1950.0300000              0.0008130        
  5    834.4630000              0.0027730        
  6    386.9900000              0.0086180        
  7    189.3720000              0.0243890        
  8     96.2845000              0.0613800        
  9     50.4640000              0.1315120        
 10     27.1483000              0.2254540        
 11     14.9256000              0.2991520        
 12      8.3161700              0.2750970        
 13      4.6208600              0.1389430        
 14      2.5113800              0.0274120        
 15      1.3309100             -0.0003570        
 16      0.6904150             -0.0016060        
 17      0.3432070             -0.0007230        
 18      0.1459030             -0.0000470        
 19      0.0629230             -0.0000080        
P   19
  1  67602.1000000             -0.0000060        
  2  16330.1000000             -0.0000190        
  3   5149.5900000             -0.0000780        
  4   1950.0300000             -0.0002780        
  5    834.4630000             -0.0009500        
  6    386.9900000             -0.0029650        
  7    189.3720000             -0.0084780        
  8     96.2845000             -0.0217270        
  9     50.4640000             -0.0479100        
 10     27.1483000             -0.0848350        
 11     14.9256000             -0.1182250        
 12      8.3161700             -0.1095570        
 13      4.6208600              0.0179470        
 14      2.5113800              0.2471120        
 15      1.3309100              0.4021140        
 16      0.6904150              0.3402800        
 17      0.3432070              0.1277560        
 18      0.1459030              0.0116850        
 19      0.0629230              0.0003950        
P   19
  1  67602.1000000              0.0000010        
  2  16330.1000000              0.0000050        
  3   5149.5900000              0.0000190        
  4   1950.0300000              0.0000670        
  5    834.4630000              0.0002300        
  6    386.9900000              0.0007130        
  7    189.3720000              0.0020570        
  8     96.2845000              0.0052380        
  9     50.4640000              0.0116840        
 10     27.1483000              0.0205230        
 11     14.9256000              0.0292840        
 12      8.3161700              0.0263730        
 13      4.6208600             -0.0065840        
 14      2.5113800             -0.0738030        
 15      1.3309100             -0.1194390        
 16      0.6904150             -0.1240420        
 17      0.3432070              0.0379050        
 18      0.1459030              0.3730470        
 19      0.0629230              0.5239770        
P   19
  1  67602.1000000              0.0000020        
  2  16330.1000000              0.0000060        
  3   5149.5900000              0.0000240        
  4   1950.0300000              0.0000840        
  5    834.4630000              0.0002890        
  6    386.9900000              0.0008970        
  7    189.3720000              0.0025820        
  8     96.2845000              0.0065830        
  9     50.4640000              0.0146450        
 10     27.1483000              0.0257980        
 11     14.9256000              0.0366620        
 12      8.3161700              0.0334130        
 13      4.6208600             -0.0073480        
 14      2.5113800             -0.0897590        
 15      1.3309100             -0.1469230        
 16      0.6904150             -0.1705400        
 17      0.3432070              0.0258650        
 18      0.1459030              0.6050070        
 19      0.0629230              0.4600060        
P   19
  1  67602.1000000              0.0000040        
  2  16330.1000000              0.0000110        
  3   5149.5900000              0.0000490        
  4   1950.0300000              0.0001630        
  5    834.4630000              0.0006020        
  6    386.9900000              0.0017350        
  7    189.3720000              0.0053940        
  8     96.2845000              0.0126850        
  9     50.4640000              0.0308350        
 10     27.1483000              0.0487250        
 11     14.9256000              0.0823030        
 12      8.3161700              0.0594740        
 13      4.6208600              0.0086460        
 14      2.5113800             -0.2621160        
 15      1.3309100             -0.3935920        
 16      0.6904150             -0.2871610        
 17      0.3432070              1.2506070        
 18      0.1459030              0.2254460        
 19      0.0629230             -0.8781090        
P   19
  1  67602.1000000             -0.0000040        
  2  16330.1000000             -0.0000160        
  3   5149.5900000             -0.0000560        
  4   1950.0300000             -0.0002410        
  5    834.4630000             -0.0006620        
  6    386.9900000             -0.0026190        
  7    189.3720000             -0.0058290        
  8     96.2845000             -0.0193560        
  9     50.4640000             -0.0319690        
 10     27.1483000             -0.0805560        
 11     14.9256000             -0.0704160        
 12      8.3161700             -0.1831570        
 13      4.6208600              0.1115480        
 14      2.5113800              0.3981650        
 15      1.3309100              1.0931130        
 16      0.6904150             -1.8838240        
 17      0.3432070             -0.2273100        
 18      0.1459030              1.8732010        
 19      0.0629230             -1.1618350        
P   19
  1  67602.1000000             -0.0000060        
  2  16330.1000000             -0.0000190        
  3   5149.5900000             -0.0000870        
  4   1950.0300000             -0.0002700        
  5    834.4630000             -0.0010940        
  6    386.9900000             -0.0028450        
  7    189.3720000             -0.0098880        
  8     96.2845000             -0.0208950        
  9     50.4640000             -0.0577290        
 10     27.1483000             -0.0780440        
 11     14.9256000             -0.1627120        
 12      8.3161700             -0.1599950        
 13      4.6208600              0.0926730        
 14      2.5113800              1.5778810        
 15      1.3309100             -0.8678530        
 16      0.6904150             -2.5562590        
 17      0.3432070              4.0136040        
 18      0.1459030             -2.7955480        
 19      0.0629230              0.8804900        
P   1
  1      0.0268830              1.0000000        
D   11
  1    315.8080000              0.0002050        
  2     93.6334000              0.0018340        
  3     36.0393000              0.0095670        
  4     15.6258000              0.0329840        
  5      7.2005900              0.0872900        
  6      3.4805900              0.1761900        
  7      1.7098600              0.2606360        
  8      0.8329620              0.2990220        
  9      0.3976410              0.2693220        
 10      0.1841450              0.1762820        
 11      0.0821190              0.0656500        
D   11
  1    315.8080000             -0.0002170        
  2     93.6334000             -0.0019460        
  3     36.0393000             -0.0101870        
  4     15.6258000             -0.0353910        
  5      7.2005900             -0.0959860        
  6      3.4805900             -0.1908580        
  7      1.7098600             -0.2515260        
  8      0.8329620             -0.1781850        
  9      0.3976410              0.1286570        
 10      0.1841450              0.4500970        
 11      0.0821190              0.3818610        
D   11
  1    315.8080000             -0.0003380        
  2     93.6334000             -0.0030140        
  3     36.0393000             -0.0159950        
  4     15.6258000             -0.0560850        
  5      7.2005900             -0.1575950        
  6      3.4805900             -0.2972960        
  7      1.7098600             -0.2699670        
  8      0.8329620              0.2244730        
  9      0.3976410              0.6824160        
 10      0.1841450              0.0013190        
 11      0.0821190             -0.5971310        
D   11
  1    315.8080000             -0.0004460        
  2     93.6334000             -0.0038100        
  3     36.0393000             -0.0212090        
  4     15.6258000             -0.0727570        
  5      7.2005900             -0.2287970        
  6      3.4805900             -0.3698700        
  7      1.7098600             -0.0120350        
  8      0.8329620              0.9990860        
  9      0.3976410             -0.2211580        
 10      0.1841450             -1.0290000        
 11      0.0821190              0.6624090        
D   11
  1    315.8080000              0.0005350        
  2     93.6334000              0.0056360        
  3     36.0393000              0.0266230        
  4     15.6258000              0.1140920        
  5      7.2005900              0.3131230        
  6      3.4805900              0.4547320        
  7      1.7098600             -0.9829330        
  8      0.8329620             -0.3904280        
  9      0.3976410              1.8432160        
 10      0.1841450             -1.5757380        
 11      0.0821190              0.2036060        
D   1
  1      0.0344420              1.0000000        
F   1
  1      4.6502000              1.0000000        
F   1
  1      1.5639000              1.0000000        
F   1
  1      0.5260000              1.0000000        
F   1
  1      0.1769000              1.0000000        
G   1
  1      3.3854000              1.0000000        
G   1
  1      1.0918000              1.0000000        
G   1
  1      0.3521000              1.0000000        
H   1
  1      2.4305000              1.0000000        
H   1
  1      0.6908000              1.0000000        
I   1
  1      1.5368000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Cr
data:
CHROMIUM
S   27
  1      1.35540E+08            7.988356E-06     
  2      2.42404E+07            1.931266E-05     
  3      5.41227E+06            5.501981E-05     
  4      1.44792E+06            0.0001302212     
  5 448199.0000000              0.0002927924     
  6 155899.0000000              0.00062447       
  7  59479.6000000              0.001312315      
  8  24408.1000000              0.002757895      
  9  10607.0000000              0.005886864      
 10   4823.0800000              0.01275334       
 11   2274.0800000              0.02764037       
 12   1104.5400000              0.0580299        
 13    550.0990000              0.1129400        
 14    280.0100000              0.1914790        
 15    145.3300000              0.2553998        
 16     76.7551000              0.2241805        
 17     41.1594000              0.1046212        
 18     22.3445000              0.05226127       
 19     12.2293000              0.0943261        
 20      6.7077700              0.08989426       
 21      3.6569400              0.02958319       
 22      1.9597800              0.00260282       
 23      1.0175800              0.0001529062     
 24      0.5129130             -3.148845E-05     
 25      0.1947980              3.298129E-06     
 26      0.1109690              1.448278E-05     
 27      0.0521230              2.195862E-05     
S   27
  1      1.35540E+08           -4.423503E-06     
  2      2.42404E+07           -1.069522E-05     
  3      5.41227E+06           -3.047394E-05     
  4      1.44792E+06           -7.21459E-05      
  5 448199.0000000             -0.0001622872     
  6 155899.0000000             -0.0003463873     
  7  59479.6000000             -0.0007287714     
  8  24408.1000000             -0.001534531      
  9  10607.0000000             -0.003285742      
 10   4823.0800000             -0.007158385      
 11   2274.0800000             -0.01567068       
 12   1104.5400000             -0.03354476       
 13    550.0990000             -0.0677352        
 14    280.0100000             -0.1233915        
 15    145.3300000             -0.1891323        
 16     76.7551000             -0.2118809        
 17     41.1594000             -0.1088253        
 18     22.3445000              0.1418616        
 19     12.2293000              0.4340020        
 20      6.7077700              0.4205940        
 21      3.6569400              0.1383169        
 22      1.9597800              0.01178943       
 23      1.0175800             -0.0005634646     
 24      0.5129130             -0.0006341974     
 25      0.1947980             -6.242247E-05     
 26      0.1109690              0.0001024304     
 27      0.0521230              8.812774E-05     
S   27
  1      1.35540E+08            9.507938E-07     
  2      2.42404E+07            2.29903E-06      
  3      5.41227E+06            6.55129E-06      
  4      1.44792E+06            1.551391E-05     
  5 448199.0000000              3.490796E-05     
  6 155899.0000000              7.456195E-05     
  7  59479.6000000              0.0001569865     
  8  24408.1000000              0.0003311904     
  9  10607.0000000              0.0007105562     
 10   4823.0800000              0.001556112      
 11   2274.0800000              0.003430565      
 12   1104.5400000              0.007463144      
 13    550.0990000              0.01547014       
 14    280.0100000              0.02968119       
 15    145.3300000              0.04946573       
 16     76.7551000              0.06298093       
 17     41.1594000              0.03446065       
 18     22.3445000             -0.06854433       
 19     12.2293000             -0.2618341        
 20      6.7077700             -0.3734862        
 21      3.6569400             -0.09374652       
 22      1.9597800              0.4031850        
 23      1.0175800              0.5928442        
 24      0.5129130              0.2710006        
 25      0.1947980              0.02094043       
 26      0.1109690             -0.003769577      
 27      0.0521230              0.003102853      
S   27
  1      1.35540E+08           -2.169298E-07     
  2      2.42404E+07           -5.245406E-07     
  3      5.41227E+06           -1.494719E-06     
  4      1.44792E+06           -3.539655E-06     
  5 448199.0000000             -7.964466E-06     
  6 155899.0000000             -1.701262E-05     
  7  59479.6000000             -3.581758E-05     
  8  24408.1000000             -7.557175E-05     
  9  10607.0000000             -0.0001621265     
 10   4823.0800000             -0.0003551212     
 11   2274.0800000             -0.0007829176     
 12   1104.5400000             -0.001703819      
 13    550.0990000             -0.003533391      
 14    280.0100000             -0.006786357      
 15    145.3300000             -0.01133321       
 16     76.7551000             -0.01448465       
 17     41.1594000             -0.007973652      
 18     22.3445000              0.0160128        
 19     12.2293000              0.06326731       
 20      6.7077700              0.09472229       
 21      3.6569400              0.02146664       
 22      1.9597800             -0.1199792        
 23      1.0175800             -0.2179553        
 24      0.5129130             -0.2049556        
 25      0.1947980              0.02536035       
 26      0.1109690              0.4083642        
 27      0.0521230              0.5538116        
S   27
  1      1.35540E+08           -4.324902E-07     
  2      2.42404E+07           -1.04551E-06      
  3      5.41227E+06           -2.980671E-06     
  4      1.44792E+06           -7.052143E-06     
  5 448199.0000000             -1.58966E-05      
  6 155899.0000000             -3.383913E-05     
  7  59479.6000000             -7.168719E-05     
  8  24408.1000000             -0.000149717      
  9  10607.0000000             -0.0003261726     
 10   4823.0800000             -0.0006995308     
 11   2274.0800000             -0.00158454       
 12   1104.5400000             -0.003337475      
 13    550.0990000             -0.007202878      
 14    280.0100000             -0.01318455       
 15    145.3300000             -0.02352663       
 16     76.7551000             -0.02711642       
 17     41.1594000             -0.0202532        
 18     22.3445000              0.04086224       
 19     12.2293000              0.1151279        
 20      6.7077700              0.2357592        
 21      3.6569400             -0.01495497       
 22      1.9597800             -0.2568686        
 23      1.0175800             -0.7608963        
 24      0.5129130              0.1231665        
 25      0.1947980              1.3336790        
 26      0.1109690              0.3116838        
 27      0.0521230             -0.7120654        
S   27
  1      1.35540E+08           -6.655637E-07     
  2      2.42404E+07           -1.608754E-06     
  3      5.41227E+06           -4.587504E-06     
  4      1.44792E+06           -1.08491E-05      
  5 448199.0000000             -2.447725E-05     
  6 155899.0000000             -5.20181E-05      
  7  59479.6000000             -0.0001105326     
  8  24408.1000000             -0.0002297131     
  9  10607.0000000             -0.000504199      
 10   4823.0800000             -0.001070484      
 11   2274.0800000             -0.00245684       
 12   1104.5400000             -0.005096075      
 13    550.0990000             -0.01121471       
 14    280.0100000             -0.02008902       
 15    145.3300000             -0.03704662       
 16     76.7551000             -0.04084003       
 17     41.1594000             -0.03465912       
 18     22.3445000              0.07017551       
 19     12.2293000              0.1839111        
 20      6.7077700              0.4352639        
 21      3.6569400             -0.1145446        
 22      1.9597800             -0.7658490        
 23      1.0175800             -1.3228080        
 24      0.5129130              2.3125880        
 25      0.1947980              1.1444920        
 26      0.1109690             -2.7281420        
 27      0.0521230              0.1723585        
S   27
  1      1.35540E+08            8.351431E-07     
  2      2.42404E+07            2.021012E-06     
  3      5.41227E+06            5.750406E-06     
  4      1.44792E+06            1.365756E-05     
  5 448199.0000000              3.055438E-05     
  6 155899.0000000              6.599075E-05     
  7  59479.6000000              0.0001362312     
  8  24408.1000000              0.0002968797     
  9  10607.0000000              0.0006067803     
 10   4823.0800000              0.001420496      
 11   2274.0800000              0.002878306      
 12   1104.5400000              0.006948735      
 13    550.0990000              0.01275716       
 14    280.0100000              0.02863296       
 15    145.3300000              0.03931614       
 16     76.7551000              0.06960472       
 17     41.1594000              0.007792521      
 18     22.3445000             -0.01205026       
 19     12.2293000             -0.4427734        
 20      6.7077700             -0.3877571        
 21      3.6569400              0.1015322        
 22      1.9597800              2.4134830        
 23      1.0175800             -1.3135760        
 24      0.5129130             -2.6704710        
 25      0.1947980              5.1440310        
 26      0.1109690             -2.5322670        
 27      0.0521230             -2.0012780        
S   27
  1      1.35540E+08           -1.037822E-06     
  2      2.42404E+07           -2.51344E-06      
  3      5.41227E+06           -7.141104E-06     
  4      1.44792E+06           -1.700894E-05     
  5 448199.0000000             -3.783814E-05     
  6 155899.0000000             -8.261133E-05     
  7  59479.6000000             -0.0001672367     
  8  24408.1000000             -0.0003762776     
  9  10607.0000000             -0.0007322734     
 10   4823.0800000             -0.001831629      
 11   2274.0800000             -0.003406227      
 12   1104.5400000             -0.009120497      
 13    550.0990000             -0.01478319       
 14    280.0100000             -0.03866482       
 15    145.3300000             -0.04311799       
 16     76.7551000             -0.1032378        
 17     41.1594000              0.02075082       
 18     22.3445000             -0.03914516       
 19     12.2293000              0.7650270        
 20      6.7077700              0.4583898        
 21      3.6569400             -0.8162241        
 22      1.9597800             -4.2566620        
 23      1.0175800              8.7954540        
 24      0.5129130             -6.3674240        
 25      0.1947980             -0.07718246       
 26      0.1109690              4.9948380        
 27      0.0521230             -5.5369870        
S   1
  1      0.0244890              1.0000000        
P   19
  1  72029.6000000              0.0000180        
  2  17890.9000000              0.0000580        
  3   5678.2800000              0.0002350        
  4   2138.7500000              0.0008390        
  5    905.8550000              0.0028990        
  6    415.6450000              0.0091160        
  7    201.6950000              0.0259650        
  8    102.0400000              0.0652290        
  9     53.3955000              0.1381920        
 10     28.7570000              0.2329390        
 11     15.8536000              0.3018830        
 12      8.8638500              0.2665600        
 13      4.9433400              0.1274760        
 14      2.6973200              0.0235560        
 15      1.4364300             -0.0004170        
 16      0.7485180             -0.0014190        
 17      0.3733100             -0.0006110        
 18      0.1577460             -0.0000370        
 19      0.0674450             -0.0000060        
P   19
  1  72029.6000000             -0.0000060        
  2  17890.9000000             -0.0000200        
  3   5678.2800000             -0.0000810        
  4   2138.7500000             -0.0002910        
  5    905.8550000             -0.0010080        
  6    415.6450000             -0.0031870        
  7    201.6950000             -0.0091780        
  8    102.0400000             -0.0235020        
  9     53.3955000             -0.0513060        
 10     28.7570000             -0.0894510        
 11     15.8536000             -0.1220480        
 12      8.8638500             -0.1053490        
 13      4.9433400              0.0349420        
 14      2.6973200              0.2633420        
 15      1.4364300              0.4014720        
 16      0.7485180              0.3252750        
 17      0.3733100              0.1179790        
 18      0.1577460              0.0104140        
 19      0.0674450              0.0003090        
P   19
  1  72029.6000000              0.0000020        
  2  17890.9000000              0.0000050        
  3   5678.2800000              0.0000190        
  4   2138.7500000              0.0000680        
  5    905.8550000              0.0002390        
  6    415.6450000              0.0007500        
  7    201.6950000              0.0021780        
  8    102.0400000              0.0055440        
  9     53.3955000              0.0122430        
 10     28.7570000              0.0211740        
 11     15.8536000              0.0296210        
 12      8.8638500              0.0246650        
 13      4.9433400             -0.0108710        
 14      2.6973200             -0.0772030        
 15      1.4364300             -0.1173230        
 16      0.7485180             -0.1154640        
 17      0.3733100              0.0466460        
 18      0.1577460              0.3726460        
 19      0.0674450              0.5199920        
P   19
  1  72029.6000000              0.0000020        
  2  17890.9000000              0.0000060        
  3   5678.2800000              0.0000250        
  4   2138.7500000              0.0000880        
  5    905.8550000              0.0003080        
  6    415.6450000              0.0009680        
  7    201.6950000              0.0028070        
  8    102.0400000              0.0071480        
  9     53.3955000              0.0157580        
 10     28.7570000              0.0273110        
 11     15.8536000              0.0381310        
 12      8.8638500              0.0321240        
 13      4.9433400             -0.0130760        
 14      2.6973200             -0.0972130        
 15      1.4364300             -0.1500190        
 16      0.7485180             -0.1633260        
 17      0.3733100              0.0542490        
 18      0.1577460              0.6112600        
 19      0.0674450              0.4390970        
P   19
  1  72029.6000000              0.0000040        
  2  17890.9000000              0.0000120        
  3   5678.2800000              0.0000530        
  4   2138.7500000              0.0001780        
  5    905.8550000              0.0006580        
  6    415.6450000              0.0019430        
  7    201.6950000              0.0060100        
  8    102.0400000              0.0142900        
  9     53.3955000              0.0340490        
 10     28.7570000              0.0535590        
 11     15.8536000              0.0880820        
 12      8.8638500              0.0596580        
 13      4.9433400             -0.0075160        
 14      2.6973200             -0.3010680        
 15      1.4364300             -0.4037260        
 16      0.7485180             -0.1805400        
 17      0.3733100              1.2490040        
 18      0.1577460              0.1136350        
 19      0.0674450             -0.8277730        
P   19
  1  72029.6000000              0.0000050        
  2  17890.9000000              0.0000170        
  3   5678.2800000              0.0000630        
  4   2138.7500000              0.0002590        
  5    905.8550000              0.0007560        
  6    415.6450000              0.0028670        
  7    201.6950000              0.0068170        
  8    102.0400000              0.0213860        
  9     53.3955000              0.0371400        
 10     28.7570000              0.0867790        
 11     15.8536000              0.0821420        
 12      8.8638500              0.1832060        
 13      4.9433400             -0.1563700        
 14      2.6973200             -0.5064860        
 15      1.4364300             -0.8977050        
 16      0.7485180              1.9776090        
 17      0.3733100             -0.0784390        
 18      0.1577460             -1.6907600        
 19      0.0674450              1.1510650        
P   19
  1  72029.6000000             -0.0000070        
  2  17890.9000000             -0.0000210        
  3   5678.2800000             -0.0000960        
  4   2138.7500000             -0.0002840        
  5    905.8550000             -0.0012270        
  6    415.6450000             -0.0030680        
  7    201.6950000             -0.0113470        
  8    102.0400000             -0.0225260        
  9     53.3955000             -0.0663840        
 10     28.7570000             -0.0792560        
 11     15.8536000             -0.1962790        
 12      8.8638500             -0.1328260        
 13      4.9433400              0.2007610        
 14      2.6973200              1.6694880        
 15      1.4364300             -1.5147710        
 16      0.7485180             -1.7673040        
 17      0.3733100              3.6122160        
 18      0.1577460             -2.7767190        
 19      0.0674450              1.0038450        
P   1
  1      0.0285490              1.0000000        
D   11
  1    408.6230000              0.0001600        
  2    120.7610000              0.0014480        
  3     46.4460000              0.0078230        
  4     20.2390000              0.0281850        
  5      9.3638100              0.0772900        
  6      4.5309400              0.1641140        
  7      2.2314000              0.2548640        
  8      1.0877600              0.3022260        
  9      0.5173840              0.2792280        
 10      0.2371640              0.1870480        
 11      0.1033080              0.0708990        
D   11
  1    408.6230000             -0.0001810        
  2    120.7610000             -0.0016430        
  3     46.4460000             -0.0089270        
  4     20.2390000             -0.0323460        
  5      9.3638100             -0.0912500        
  6      4.5309400             -0.1928490        
  7      2.2314000             -0.2645410        
  8      1.0877600             -0.1867400        
  9      0.5173840              0.1269280        
 10      0.2371640              0.4503720        
 11      0.1033080              0.3818950        
D   11
  1    408.6230000             -0.0002610        
  2    120.7610000             -0.0023550        
  3     46.4460000             -0.0129600        
  4     20.2390000             -0.0472650        
  5      9.3638100             -0.1386330        
  6      4.5309400             -0.2864130        
  7      2.2314000             -0.2875130        
  8      1.0877600              0.1816790        
  9      0.5173840              0.6898620        
 10      0.2371640              0.0343680        
 11      0.1033080             -0.6335340        
D   11
  1    408.6230000             -0.0003830        
  2    120.7610000             -0.0032790        
  3     46.4460000             -0.0190900        
  4     20.2390000             -0.0677960        
  5      9.3638100             -0.2245640        
  6      4.5309400             -0.4060110        
  7      2.2314000             -0.0277500        
  8      1.0877600              0.9973750        
  9      0.5173840             -0.1697640        
 10      0.2371640             -1.0397890        
 11      0.1033080              0.6710790        
D   11
  1    408.6230000              0.0004370        
  2    120.7610000              0.0045890        
  3     46.4460000              0.0227170        
  4     20.2390000              0.0996160        
  5      9.3638100              0.3058450        
  6      4.5309400              0.4774610        
  7      2.2314000             -0.9325180        
  8      1.0877600             -0.4753000        
  9      0.5173840              1.8742470        
 10      0.2371640             -1.5688730        
 11      0.1033080              0.2238730        
D   1
  1      0.0414480              1.0000000        
F   1
  1      5.5809000              1.0000000        
F   1
  1      1.8872000              1.0000000        
F   1
  1      0.6382000              1.0000000        
F   1
  1      0.2158000              1.0000000        
G   1
  1      4.0728000              1.0000000        
G   1
  1      1.3180000              1.0000000        
G   1
  1      0.4265000              1.0000000        
H   1
  1      2.9754000              1.0000000        
H   1
  1      0.8661000              1.0000000        
I   1
  1      2.0805000              1.0000000        


name: cc-pV5Z-DK
description: V5Z4P Douglas-Kroll Valence Quintuple Zeta + Polarization
elt: Mn
data:
MANGANESE
S   27
  1      1.37766E+08            9.175881E-06     
  2      2.45640E+07            2.220837E-05     
  3      5.47999E+06            6.312902E-05     
  4      1.46664E+06            0.000149043      
  5 454421.0000000              0.000334252      
  6 158216.0000000              0.0007110598     
  7  60404.3000000              0.001490706      
  8  24793.6000000              0.003125433      
  9  10772.3000000              0.00665555       
 10   4895.5400000              0.01438106       
 11   2306.5600000              0.03106181       
 12   1119.5600000              0.06485971       
 13    557.3810000              0.1250063        
 14    283.7780000              0.2083100        
 15    147.4360000              0.2695263        
 16     78.0227000              0.2254809        
 17     41.9679000              0.09819842       
 18     22.8778000              0.04363582       
 19     12.5845000              0.0696258        
 20      6.9417000              0.05919984       
 21      3.8062900              0.01745965       
 22      2.0503100              0.001273075      
 23      1.0683800             -8.199702E-05     
 24      0.5366060             -8.846319E-05     
 25      0.1832600             -6.838112E-07     
 26      0.1052970              9.2988E-06       
 27      0.0514640              1.077915E-05     
S   27
  1      1.37766E+08           -4.381338E-06     
  2      2.45640E+07           -1.060525E-05     
  3      5.47999E+06           -3.015144E-05     
  4      1.46664E+06           -7.120841E-05     
  5 454421.0000000             -0.0001597824     
  6 158216.0000000             -0.000340203      
  7  60404.3000000             -0.0007142262     
  8  24793.6000000             -0.001500807      
  9  10772.3000000             -0.003208026      
 10   4895.5400000             -0.006976942      
 11   2306.5600000             -0.01525116       
 12   1119.5600000             -0.0325723        
 13    557.3810000             -0.06555716       
 14    283.7780000             -0.1186999        
 15    147.4360000             -0.1799524        
 16     78.0227000             -0.1951121        
 17     41.9679000             -0.08217273       
 18     22.8778000              0.1808616        
 19     12.5845000              0.4586460        
 20      6.9417000              0.3972272        
 21      3.8062900              0.1168848        
 22      2.0503100              0.007958495      
 23      1.0683800             -0.002092204      
 24      0.5366060             -0.001135142      
 25      0.1832600             -7.879372E-05     
 26      0.1052970              0.0001025231     
 27      0.0514640              5.410158E-05     
S   27
  1      1.37766E+08            1.068287E-06     
  2      2.45640E+07            2.586031E-06     
  3      5.47999E+06            7.352933E-06     
  4      1.46664E+06            1.736941E-05     
  5 454421.0000000              3.898542E-05     
  6 158216.0000000              8.306111E-05     
  7  60404.3000000              0.0001744949     
  8  24793.6000000              0.0003673057     
  9  10772.3000000              0.0007865417     
 10   4895.5400000              0.001718715      
 11   2306.5600000              0.00378089       
 12   1119.5600000              0.008193983      
 13    557.3810000              0.01688439       
 14    283.7780000              0.03203007       
 15    147.4360000              0.05227776       
 16     78.0227000              0.06329496       
 17     41.9679000              0.02730142       
 18     22.8778000             -0.08717741       
 19     12.5845000             -0.2875772        
 20      6.9417000             -0.3628884        
 21      3.8062900             -0.04215027       
 22      2.0503100              0.4388709        
 23      1.0683800              0.5771293        
 24      0.5366060              0.2387704        
 25      0.1832600              0.01570217       
 26      0.1052970             -0.004203808      
 27      0.0514640              0.003045068      
S   27
  1      1.37766E+08           -2.38094E-07      
  2      2.45640E+07           -5.763617E-07     
  3      5.47999E+06           -1.638783E-06     
  4      1.46664E+06           -3.871248E-06     
  5 454421.0000000             -8.688905E-06     
  6 158216.0000000             -1.851283E-05     
  7  60404.3000000             -3.889181E-05     
  8  24793.6000000             -8.18682E-05      
  9  10772.3000000             -0.0001753253     
 10   4895.5400000             -0.000383106      
 11   2306.5600000             -0.0008430459     
 12   1119.5600000             -0.001827049      
 13    557.3810000             -0.003768381      
 14    283.7780000             -0.0071523        
 15    147.4360000             -0.01170913       
 16     78.0227000             -0.01421051       
 17     41.9679000             -0.006206358      
 18     22.8778000              0.02000513       
 19     12.5845000              0.06799373       
 20      6.9417000              0.09008027       
 21      3.8062900              0.006726841      
 22      2.0503100             -0.1266192        
 23      1.0683800             -0.2141210        
 24      0.5366060             -0.1856184        
 25      0.1832600              0.0909400        
 26      0.1052970              0.4118037        
 27      0.0514640              0.5094118        
S   27
  1      1.37766E+08           -4.84787E-07      
  2      2.45640E+07           -1.173096E-06     
  3      5.47999E+06           -3.337866E-06     
  4      1.46664E+06           -7.874209E-06     
  5 454421.0000000             -1.77214E-05      
  6 158216.0000000             -3.756312E-05     
  7  60404.3000000             -7.964774E-05     
  8  24793.6000000             -0.000165119      
  9  10772.3000000             -0.0003618268     
 10   4895.5400000             -0.0007660144     
 11   2306.5600000             -0.00175539       
 12   1119.5600000             -0.003620866      
 13    557.3810000             -0.007932822      
 14    283.7780000             -0.01397326       
 15    147.4360000             -0.02536594       
 16     78.0227000             -0.02583964       
 17     41.9679000             -0.01989071       
 18     22.8778000              0.05587662       
 19     12.5845000              0.1164236        
 20      6.9417000              0.2517457        
 21      3.8062900             -0.08002852       
 22      2.0503100             -0.2433200        
 23      1.0683800             -0.8158726        
 24      0.5366060              0.3234709        
 25      0.1832600              1.5214530        
 26      0.1052970             -0.1148130        
 27      0.0514640             -0.6387061        
S   27
  1      1.37766E+08           -7.512011E-07     
  2      2.45640E+07           -1.817618E-06     
  3      5.47999E+06           -5.172616E-06     
  4      1.46664E+06           -1.21987E-05      
  5 454421.0000000             -2.747141E-05     
  6 158216.0000000             -5.816137E-05     
  7  60404.3000000             -0.0001235878     
  8  24793.6000000             -0.0002553343     
  9  10772.3000000             -0.0005624479     
 10   4895.5400000             -0.001182468      
 11   2306.5600000             -0.002734688      
 12   1119.5600000             -0.005582357      
 13    557.3810000             -0.01239937       
 14    283.7780000             -0.0215283        
 15    147.4360000             -0.04003117       
 16     78.0227000             -0.03951846       
 17     41.9679000             -0.03357302       
 18     22.8778000              0.09316877       
 19     12.5845000              0.1936863        
 20      6.9417000              0.4576255        
 21      3.8062900             -0.2269693        
 22      2.0503100             -0.8205798        
 23      1.0683800             -1.1703670        
 24      0.5366060              2.4796750        
 25      0.1832600              0.5071965        
 26      0.1052970             -2.4559780        
 27      0.0514640              0.4637332        
S   27
  1      1.37766E+08            9.501859E-07     
  2      2.45640E+07            2.302638E-06     
  3      5.47999E+06            6.534031E-06     
  4      1.46664E+06            1.549527E-05     
  5 454421.0000000              3.451419E-05     
  6 158216.0000000              7.462236E-05     
  7  60404.3000000              0.0001527131     
  8  24793.6000000              0.0003356054     
  9  10772.3000000              0.0006735275     
 10   4895.5400000              0.001608663      
 11   2306.5600000              0.003158595      
 12   1119.5600000              0.007873457      
 13    557.3810000              0.01373173       
 14    283.7780000              0.03227593       
 15    147.4360000              0.03976109       
 16     78.0227000              0.07706429       
 17     41.9679000             -0.01214183       
 18     22.8778000             -0.005722879      
 19     12.5845000             -0.5354706        
 20      6.9417000             -0.2928017        
 21      3.8062900              0.09232953       
 22      2.0503100              2.8929030        
 23      1.0683800             -2.5729720        
 24      0.5366060             -1.3308900        
 25      0.1832600              5.1351630        
 26      0.1052970             -3.8523080        
 27      0.0514640             -0.9550986        
S   27
  1      1.37766E+08           -1.128118E-06     
  2      2.45640E+07           -2.733535E-06     
  3      5.47999E+06           -7.758502E-06     
  4      1.46664E+06           -1.839184E-05     
  5 454421.0000000             -4.099951E-05     
  6 158216.0000000             -8.851677E-05     
  7  60404.3000000             -0.0001816369     
  8  24793.6000000             -0.0003975353     
  9  10772.3000000             -0.0008030675     
 10   4895.5400000             -0.001902448      
 11   2306.5600000             -0.003779167      
 12   1119.5600000             -0.009307704      
 13    557.3810000             -0.0165406        
 14    283.7780000             -0.03821704       
 15    147.4360000             -0.04887395       
 16     78.0227000             -0.09128293       
 17     41.9679000              0.008491437      
 18     22.8778000              0.02611301       
 19     12.5845000              0.7079390        
 20      6.9417000              0.6498609        
 21      3.8062900             -1.5963690        
 22      2.0503100             -3.2731990        
 23      1.0683800              8.6437670        
 24      0.5366060             -7.1910560        
 25      0.1832600              2.6285060        
 26      0.1052970              1.9458760        
 27      0.0514640             -4.4344500        
S   1
  1      0.0246780              1.0000000        
P   19
  1  79296.8000000              0.0000200        
  2  19317.1000000              0.0000630        
  3   6114.1000000              0.0002480        
  4   2316.2600000              0.0008630        
  5    989.6900000              0.0029100        
  6    457.9420000              0.0090030        
  7    223.6420000              0.0254540        
  8    113.5940000              0.0639330        
  9     59.5621000              0.1361980        
 10     32.1072000              0.2315300        
 11     17.7103000              0.3023300        
 12      9.9062100              0.2689820        
 13      5.5224300              0.1295470        
 14      3.0083200              0.0233200        
 15      1.5987300             -0.0015660        
 16      0.8308680             -0.0023560        
 17      0.4135380             -0.0009350        
 18      0.1712140             -0.0000620        
 19      0.0721220             -0.0000060        
P   19
  1  79296.8000000             -0.0000070        
  2  19317.1000000             -0.0000220        
  3   6114.1000000             -0.0000860        
  4   2316.2600000             -0.0003000        
  5    989.6900000             -0.0010160        
  6    457.9420000             -0.0031590        
  7    223.6420000             -0.0090310        
  8    113.5940000             -0.0231260        
  9     59.5621000             -0.0507790        
 10     32.1072000             -0.0893990        
 11     17.7103000             -0.1228770        
 12      9.9062100             -0.1065140        
 13      5.5224300              0.0357560        
 14      3.0083200              0.2669420        
 15      1.5987300              0.4036250        
 16      0.8308680              0.3225890        
 17      0.4135380              0.1156130        
 18      0.1712140              0.0099950        
 19      0.0721220              0.0001640        
P   19
  1  79296.8000000             -0.0000020        
  2  19317.1000000             -0.0000050        
  3   6114.1000000             -0.0000200        
  4   2316.2600000             -0.0000690        
  5    989.6900000             -0.0002350        
  6    457.9420000             -0.0007240        
  7    223.6420000             -0.0020910        
  8    113.5940000             -0.0053130        
  9     59.5621000             -0.0118180        
 10     32.1072000             -0.0205920        
 11     17.7103000             -0.0290740        
 12      9.9062100             -0.0242130        
 13      5.5224300              0.0103870        
 14      3.0083200              0.0758020        
 15      1.5987300              0.1132510        
 16      0.8308680              0.1107600        
 17      0.4135380             -0.0458160        
 18      0.1712140             -0.3666060        
 19      0.0721220             -0.5209940        
P   19
  1  79296.8000000              0.0000020        
  2  19317.1000000              0.0000070        
  3   6114.1000000              0.0000270        
  4   2316.2600000              0.0000940        
  5    989.6900000              0.0003190        
  6    457.9420000              0.0009840        
  7    223.6420000              0.0028430        
  8    113.5940000              0.0072090        
  9     59.5621000              0.0160560        
 10     32.1072000              0.0279420        
 11     17.7103000              0.0396110        
 12      9.9062100              0.0329680        
 13      5.5224300             -0.0131210        
 14      3.0083200             -0.1026490        
 15      1.5987300             -0.1544890        
 16      0.8308680             -0.1600600        
 17      0.4135380              0.0784490        
 18      0.1712140              0.6163740        
 19      0.0721220              0.4207930        
P   19
  1  79296.8000000              0.0000050        
  2  19317.1000000              0.0000140        
  3   6114.1000000              0.0000580        
  4   2316.2600000              0.0001920        
  5    989.6900000              0.0006960        
  6    457.9420000              0.0020080        
  7    223.6420000              0.0062130        
  8    113.5940000              0.0146760        
  9     59.5621000              0.0353990        
 10     32.1072000              0.0558380        
 11     17.7103000              0.0928570        
 12      9.9062100              0.0627380        
 13      5.5224300             -0.0076120        
 14      3.0083200             -0.3326500        
 15      1.5987300             -0.4106540        
 16      0.8308680             -0.1060750        
 17      0.4135380              1.2223080        
 18      0.1712140              0.0490250        
 19      0.0721220             -0.7934070        
P   19
  1  79296.8000000              0.0000060        
  2  19317.1000000              0.0000200        
  3   6114.1000000              0.0000710        
  4   2316.2600000              0.0002850        
  5    989.6900000              0.0008150        
  6    457.9420000              0.0030400        
  7    223.6420000              0.0071830        
  8    113.5940000              0.0225240        
  9     59.5621000              0.0396270        
 10     32.1072000              0.0922750        
 11     17.7103000              0.0881760        
 12      9.9062100              0.1941840        
 13      5.5224300             -0.1735320        
 14      3.0083200             -0.6083310        
 15      1.5987300             -0.7382110        
 16      0.8308680              2.0243030        
 17      0.4135380             -0.3298290        
 18      0.1712140             -1.4935320        
 19      0.0721220              1.1177440        
P   19
  1  79296.8000000              0.0000080        
  2  19317.1000000              0.0000250        
  3   6114.1000000              0.0001060        
  4   2316.2600000              0.0003420        
  5    989.6900000              0.0012720        
  6    457.9420000              0.0035810        
  7    223.6420000              0.0114470        
  8    113.5940000              0.0264520        
  9     59.5621000              0.0662750        
 10     32.1072000              0.1011730        
 11     17.7103000              0.1824440        
 12      9.9062100              0.2264760        
 13      5.5224300             -0.4191550        
 14      3.0083200             -1.7434020        
 15      1.5987300              2.2743340        
 16      0.8308680              0.6841410        
 17      0.4135380             -2.8576890        
 18      0.1712140              2.5150700        
 19      0.0721220             -1.0349870        
P   1
  1      0.0301100              1.0000000        
D   11
  1    449.7850000              0.0001690        
  2    132.7510000              0.0015380        
  3     50.9528000              0.0083670        
  4     22.1594000              0.0303140        
  5     10.2612000              0.0828020        
  6      4.9780300              0.1723770        
  7      2.4573000              0.2608660        
  8      1.2010100              0.3011350        
  9      0.5725160              0.2713710        
 10      0.2625960              0.1780740        
 11      0.1141400              0.0677740        
D   11
  1    449.7850000             -0.0001730        
  2    132.7510000             -0.0015710        
  3     50.9528000             -0.0085770        
  4     22.1594000             -0.0312520        
  5     10.2612000             -0.0873880        
  6      4.9780300             -0.1828420        
  7      2.4573000             -0.2505620        
  8      1.2010100             -0.1725500        
  9      0.5725160              0.1183370        
 10      0.2625960              0.4199520        
 11      0.1141400              0.4092760        
D   11
  1    449.7850000             -0.0002730        
  2    132.7510000             -0.0024890        
  3     50.9528000             -0.0137240        
  4     22.1594000             -0.0506030        
  5     10.2612000             -0.1473270        
  6      4.9780300             -0.2974210        
  7      2.4573000             -0.2738540        
  8      1.2010100              0.1901550        
  9      0.5725160              0.6286420        
 10      0.2625960              0.1058660        
 11      0.1141400             -0.5751650        
D   11
  1    449.7850000             -0.0003450        
  2    132.7510000             -0.0031230        
  3     50.9528000             -0.0174550        
  4     22.1594000             -0.0644950        
  5     10.2612000             -0.2022090        
  6      4.9780300             -0.4044630        
  7      2.4573000             -0.0249760        
  8      1.2010100              0.9272090        
  9      0.5725160             -0.0725570        
 10      0.2625960             -0.9877520        
 11      0.1141400              0.4393010        
D   11
  1    449.7850000              0.0004430        
  2    132.7510000              0.0041250        
  3     50.9528000              0.0227360        
  4     22.1594000              0.0894400        
  5     10.2612000              0.3004590        
  6      4.9780300              0.4539710        
  7      2.4573000             -0.8298630        
  8      1.2010100             -0.5280360        
  9      0.5725160              1.6092210        
 10      0.2625960             -0.9535770        
 11      0.1141400             -0.3842430        
D   1
  1      0.0456420              1.0000000        
F   1
  1      6.5165000              1.0000000        
F   1
  1      2.2307000              1.0000000        
F   1
  1      0.7636000              1.0000000        
F   1
  1      0.2614000              1.0000000        
G   1
  1      4.8899000              1.0000000        
G   1
  1      1.6140000              1.0000000        
G   1
  1      0.5327000              1.0000000        
H   1
  1      3.5472000              1.0000000        
H   1
  1      1.0636000              1.0000000        
I   1
  1      2.5736000              1.0000000        


