# all_value

name: 4-22GSP
description: VDZD Valence Double Zeta
elt: H
data:
HYDROGEN
S   2
  1     13.01072961             0.13140985       
  2      1.96226117             0.92113973       
S   2
  1      0.44453873             0.52276833       
  2      0.12194975             0.54767537


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: He
data:
HELIUM
S   2
  1     38.35494849             0.14069699       
  2      5.76890973             0.91521787       
S   2
  1      1.23994099             0.51813571       
  2      0.29757820             0.56557984


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Li
data:
LITHIUM
S   4
  1      6.22125269             0.78078507       
  2     22.26326619             0.24241842       
  3     97.91236393             0.05071977       
  4    651.92839884             0.00665110       
L   2
  1      0.63321114             0.44939164             0.97820115       
  2      1.93174060             0.60321101             0.03119495       
L   2
  1      0.07245156             0.50531424             0.56074416       
  2      0.02810692             0.53432442             0.50410730


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Be
data:
BERYLLIUM
S   4
  1   1281.42397277             0.00638749       
  2    192.45605825             0.04892235       
  3     43.77835437             0.23614153       
  4     12.28075755             0.78695107       
L   2
  1      3.86052205             0.58292539             0.04905946       
  2      1.28861524             0.46864909             0.96511292       
L   2
  1      0.18032110             0.47475993             0.65568982       
  2      0.05908650             0.57855155             0.42762693


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: B
data:
BORON
S   4
  1     14.79897262             0.77662984       
  2     53.13843475             0.24686659       
  3    233.85790611             0.05163985       
  4   1556.51868555             0.00681146       
L   2
  1      4.57294690             0.73186174             0.21300003       
  2      1.46513514             0.31450844             0.84277253       
L   2
  1      0.39518725             0.41196632             0.52135350       
  2      0.11158418             0.65194061             0.58750765


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: C
data:
CARBON
S   4
  1   2324.66403640             0.00663675       
  2    349.22183834             0.05032142       
  3     79.30064261             0.24296909       
  4     22.00625885             0.78100128       
L   2
  1      2.03555827             0.29772524             0.83312648       
  2      6.70420429             0.75088759             0.23076135       
L   2
  1      0.16609441             0.62020310             0.56506972       
  2      0.59447987             0.44649554             0.54578458


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: N
data:
NITROGEN
S   4
  1   3386.19941553             0.00641147       
  2    508.59363913             0.04868181       
  3    115.40912068             0.23762421       
  4     31.91269701             0.78678387       
L   2
  1      2.83669640             0.30406025             0.83511465       
  2      9.60715253             0.74721161             0.23127996       
L   2
  1      0.23256375             0.60843918             0.55262789       
  2      0.84088243             0.45976217             0.55978358


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: O
data:
OXYGEN
S   4
  1   4530.85789482             0.00629477       
  2    680.44844407             0.04781525       
  3    154.30182625             0.23478343       
  4     42.51652760             0.78995730       
L   2
  1     12.66325987             0.75787199             0.23116747       
  2      3.61036077             0.29493484             0.83821981       
L   2
  1      1.07505981             0.51349540             0.56437073       
  2      0.29132961             0.55805188             0.55109873


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: F
data:
FLUORINE
S   4
  1   5968.40531277             0.00615808       
  2    896.22492628             0.04681854       
  3    203.09522485             0.23139253       
  4     55.77547708             0.79364873       
L   2
  1      4.60278108             0.29709745             0.84129192       
  2     16.46243652             0.75737271             0.22935227       
L   2
  1      0.36375539             0.53531867             0.54746365       
  2      1.36409288             0.53794985             0.57040224


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Ne
data:
NEON
S   4
  1   7685.45939082             0.79717471       
  2   1153.90851265             0.22813533       
  3    261.31379877             0.04587396       
  4     71.53455115             0.00602839       
L   2
  1     20.94394754             0.75329552             0.22718062       
  2      5.78220492             0.30276279             0.84402536       
L   2
  1      1.70420037             0.54844461             0.57537507       
  2      0.44903774             0.52597488             0.54426066


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Na
data:
SODIUM
S   4
  1  59005.87155763             0.00473939       
  2   8843.17387951             0.03779888       
  3   2008.73059640             0.19013983       
  4    561.94736148             0.83239318       
L   4
  1    176.57226717             0.12269887             0.01362284       
  2     60.11032461             0.31677325             0.05599760       
  3     21.95871851             0.47071062             0.24587058       
  4      8.29021291             0.20968897             0.77166316       
L   3
  1      3.13691110             0.15878594             0.40992238       
  2      1.16235250             0.70831804             0.48327929       
  3      0.41713128             0.18687630             0.24777554       
L   1
  1      0.04160676             1.0000000              1.0000000


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Mg
data:
MAGNESIUM
S   4
  1  72842.35243521             0.00470575       
  2  10916.45507428             0.03764326       
  3   2479.23513566             0.18879433       
  4    692.83977420             0.83367701       
L   4
  1    217.09037882             0.11888710             0.01331108       
  2     73.67846021             0.31134881             0.05554740       
  3     26.88307904             0.47172841             0.24610458       
  4     10.17580589             0.21783346             0.77153877       
L   3
  1      3.88805740             0.14535014             0.42846748       
  2      1.48421463             0.72669529             0.48100724       
  3      0.56453065             0.17444781             0.21798770       
L   1
  1      0.07083222             1.0000000              1.0000000


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Al
data:
ALUMINUM
S   4
  1  62847.68542369             0.00475706       
  2   9420.16948493             0.03784895       
  3   2138.10104481             0.19058192       
  4    595.28581279             0.83227640       
L   4
  1    184.47770208             0.17034259             0.01483406       
  2     61.57337332             0.40729042             0.05880090       
  3     22.14917918             0.44731093             0.26515058       
  4      7.84435316             0.08860339             0.75969233       
L   2
  1      2.84554383             0.57185919             0.63633007       
  2      1.02702844             0.47324522             0.43521388       
L   2
  1      0.19997297             0.45592907             0.48344484       
  2      0.06422400             0.59864031             0.60579422


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Si
data:
SILICON
S   4
  1  77268.41073923             0.00471727       
  2  11581.04064378             0.03765241       
  3   2628.14424648             0.18908175       
  4    731.10993167             0.83369708       
L   4
  1    226.12652055             0.16102878             0.01431625       
  2     75.34502197             0.39416686             0.05813094       
  3     27.09086423             0.45783226             0.26284309       
  4      9.68420613             0.10169375             0.76124411       
L   2
  1      3.56305299             0.53341058             0.63975798       
  2      1.32109381             0.50987761             0.42806093       
L   2
  1      0.29548054             0.44214995             0.51462114       
  2      0.09299312             0.61371257             0.57844461


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: P
data:
PHOSPHORUS
S   4
  1  92357.70879877             0.00468580       
  2  13842.04110935             0.03749475       
  3   3140.72424901             0.18789116       
  4    872.93283981             0.83483671       
L   4
  1    269.41958607             0.15518186             0.01395191       
  2     89.58495929             0.38606128             0.05772958       
  3     32.18731171             0.46394981             0.26158571       
  4     11.57634306             0.11013903             0.76203850       
L   2
  1      4.30278928             0.51349477             0.64778594       
  2      1.62972925             0.52807824             0.41681222       
L   2
  1      0.40064094             0.43505843             0.53813549       
  2      0.12553218             0.62090850             0.55590096


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: S
data:
SULFUR
S   4
  1 105207.77721164             0.00466626       
  2  15767.60700913             0.03738270       
  3   3576.84913332             0.18716417       
  4    992.96958124             0.83557729       
L   4
  1    305.54462944             0.15631361             0.01389503       
  2    101.24885897             0.39007346             0.05812291       
  3     36.31918553             0.46274983             0.26323355       
  4     13.06567166             0.10572295             0.76040208       
L   2
  1      4.87714887             0.54226236             0.67449592       
  2      1.87944449             0.49786071             0.38608298       
L   2
  1      0.49984510             0.47845866             0.56494619       
  2      0.15195999             0.58160802             0.53338470


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Cl
data:
CHLORINE
S   4
  1 117980.86046310             0.00465032       
  2  17681.61590091             0.03728028       
  3   4010.11959383             0.18659505       
  4   1111.87202959             0.83618135       
L   4
  1    341.05747400             0.15885258             0.01388550       
  2    112.60380446             0.39651064             0.05867183       
  3     40.31473566             0.45992126             0.26517685       
  4     14.48710148             0.09890034             0.75855829       
L   2
  1      5.41737647             0.58368081             0.70526712       
  2      2.10703882             0.45514756             0.35157984       
L   2
  1      0.60311140             0.50916680             0.59206431       
  2      0.18190769             0.55215437             0.50682259


name: 4-22GSP
description: VDZD Valence Double Zeta
elt: Ar
data:
ARGON
S   4
  1 131046.47324332             0.00463624       
  2  19639.52538669             0.03718266       
  3   4453.13641931             0.18611062       
  4   1233.16552904             0.83671117       
L   4
  1    377.07378686             0.16190511             0.01388563       
  2    124.03617925             0.40375525             0.05929867       
  3     44.31532406             0.45627568             0.26703142       
  4     15.90074003             0.09149139             0.75679618       
L   2
  1      5.94816287             0.63044981             0.73716507       
  2      2.31389200             0.40707137             0.31637208       
L   2
  1      0.70740511             0.47773574             0.61939692       
  2      0.21416492             0.52488802             0.53618685


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: H
data:
HYDROGEN
S   2
  1      4.50036231             0.15631167       
  2      0.68128924             0.90466909       
S   1
  1      0.15137639             1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: He
data:
HELIUM
S   2
  1     13.62310172             0.17525420       
  2      1.99894370             0.89346310       
S   1
  1      0.38294258             1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Li
data:
LITHIUM
S   3
  1    261.70980712             0.02718392       
  2     39.38599444             0.19946919       
  3      8.90009112             0.84471834       
L   2
  1      2.40550517             0.56680799            -0.00031685       
  2      0.70564043             0.49693207             1.00020338       
L   1
  1      0.04779874             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Be
data:
BERYLLIUM
S   3
  1    503.79744442             0.02656239       
  2     75.82361701             0.19608914       
  3     17.18781371             0.84744314       
L   2
  1      4.71330223             0.55252358            -0.00939323       
  2      1.41880203             0.50897851             1.00611127       
L   1
  1      0.10454891             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: B
data:
BORON
S   3
  1    338.23459961             0.03374414       
  2     50.98058060             0.23775108       
  3     11.39060370             0.81212145       
L   2
  1      0.56716863             0.22649943             0.43916998       
  2      0.14236995             0.82508535             0.68095885       
L   1
  1      3.03182778             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: C
data:
CARBON
S   3
  1    499.24042249             0.03330322       
  2     75.25419194             0.23617745       
  3     16.86538669             0.81336259       
L   2
  1      0.89739483             0.24008573             0.46214684       
  2      0.21746772             0.81603757             0.66529098       
L   1
  1      4.52660451             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: N
data:
NITROGEN
S   3
  1    693.92431602             0.03294106       
  2    104.60302038             0.23480293       
  3     23.49023698             0.81448223       
L   2
  1      1.29068964             0.24876782             0.47669382       
  2      0.30742289             0.80997026             0.65455215       
L   1
  1      6.33456675             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: O
data:
OXYGEN
S   3
  1    910.10034975             0.03280967       
  2    137.19711335             0.23422391       
  3     30.85279077             0.81490980       
L   2
  1      1.72885887             0.27389659             0.48155753       
  2      0.39954770             0.79112437             0.65447861       
L   1
  1      8.35065975             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: F
data:
FLUORINE
S   3
  1   1162.26781448             0.03263225       
  2    175.21411023             0.23347259       
  3     39.44340117             0.81551836       
L   2
  1      0.50746974             0.78100062             0.65148993       
  2      2.23562751             0.28752950             0.48768552       
L   1
  1     10.69908170             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Ne
data:
NEON
S   3
  1   1451.46006052             0.03243674       
  2    218.80907282             0.23265762       
  3     49.29660639             0.81620225       
L   2
  1      0.63139230             0.77597368             0.64847256       
  2      2.81447474             0.29455064             0.49285246       
L   1
  1     13.38895401             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Na
data:
SODIUM
S   3
  1   7320.01017255             0.02330366       
  2   1099.21475690             0.17562017       
  3    248.47102766             0.86488331       
L   3
  1     68.10517280             0.35402828             0.04620771       
  2     20.86612762             0.57357508             0.21347098       
  3      6.49460139             0.16735016             0.82763041       
L   2
  1      2.02508269             0.55189794             0.61044572       
  2      0.60635153             0.51011058             0.48877599       
L   1
  1      0.04204431             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Mg
data:
MAGNESIUM
S   3
  1   9468.12001271             0.02306231       
  2   1421.53310401             0.17358024       
  3    321.28960847             0.86656933       
L   3
  1     88.08064448             0.32783062             0.04567364       
  2     27.01701160             0.57073610             0.21085454       
  3      8.58718567             0.19859933             0.82810900       
L   2
  1      2.74393227             0.48410538             0.60906292       
  2      0.85790107             0.57355367             0.48389573       
L   1
  1      0.07206199             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Al
data:
ALUMINUM
S   3
  1  11793.72923854             0.02289401       
  2   1770.45604036             0.17213922       
  3    400.06339907             0.86776492       
L   3
  1    109.64007023             0.31053456             0.04518149       
  2     33.64784884             0.56662400             0.20928045       
  3     10.83737466             0.22119953             0.82842769       
L   2
  1      3.52543096             0.44069202             0.61177585       
  2      1.14261480             0.61258277             0.47588924       
L   1
  1      0.11329401             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Si
data:
SILICON
S   3
  1  13955.62828382             0.02280973       
  2   2094.81304780             0.17143469       
  3    473.12990622             0.86836878       
L   3
  1    129.47403982             0.30616268             0.02280973       
  2     39.69162349             0.56633497             0.20971725       
  3     12.82658551             0.22599843             0.82791361       
L   2
  1      4.22201068             0.43766794             0.62814268       
  2      1.41747555             0.61251885             0.45369543       
L   1
  1      0.16388839             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: P
data:
PHOSPHORUS
S   3
  1  15151.94544206             0.02286522       
  2   2274.34114677             0.17211413       
  3    513.08292993             0.86787870       
L   3
  1    139.82036038             0.32700602             0.02286522       
  2     42.66229825             0.57438945             0.21457368       
  3     13.59162817             0.19529712             0.82515660       
L   2
  1      4.47317336             0.52884813             0.68437788       
  2      1.55838863             0.51967461             0.38812323       
L   1
  1      0.22034376             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: S
data:
SULFUR
S   3
  1  12715.98885260             0.02351515       
  2   1909.10567091             0.17838697       
  3    429.10047704             0.86294128       
L   3
  1    115.28566038             0.45398660             0.05086938       
  2     34.54429948             0.56134562             0.25016598       
  3     10.43210743             0.06479410             0.79886860       
L   2
  1      0.78345876             0.16040437             0.34297956       
  2      0.21432503             0.87484226             0.75275946       
L   1
  1      3.22980606             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Cl
data:
CHLORINE
S   3
  1  14500.35608106             0.02344138       
  2   2176.80649430             0.17792925       
  3    488.98549689             0.86335580       
L   3
  1    131.13866026             0.45303954             0.05090772       
  2     39.21942166             0.56317356             0.25001320       
  3     11.88944993             0.06363089             0.79862678       
L   2
  1      0.86996225             0.23130821             0.39700121       
  2      0.24627185             0.81374263             0.70223876       
L   1
  1      3.72213855             1.0000000              1.0000000


name: 3-21GSP
description: VDZD Valence Double Zeta
elt: Ar
data:
ARGON
S   3
  1  16573.92190582             0.02334667       
  2   2487.85495144             0.17728956       
  3    558.59858877             0.86391334       
L   3
  1    149.60980979             0.44744675             0.05057537       
  2     44.69492563             0.56627977             0.24944607       
  3     13.60706499             0.06672096             0.79882484       
L   2
  1      1.00805419             0.26333730             0.42617459       
  2      0.28776986             0.78554563             0.67513936       
L   1
  1      4.30954676             1.0000000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: Na
data:
SODIUM
S   3
  1    547.6130000              0.0674911        
  2     82.0678000              0.3935050        
  3     17.6917000              0.6656050        
L   3
  1     17.5407000             -0.1119370              0.1282330        
  2      3.7939800              0.2546540              0.4715330        
  3      0.9064410              0.8444170              0.6042730        
L   2
  1      0.5018240             -0.2196600              0.0090665        
  2      0.0609458              1.0891200              0.9972020        
L   1
  1      0.0244349              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: Mg
data:
MAGNESIUM
S   3
  1    652.8410000              0.0675982        
  2     98.3805000              0.3917780        
  3     21.2996000              0.6666610        
L   3
  1     23.3727000             -0.1102460              0.1210140        
  2      5.1995300              0.1841190              0.4628100        
  3      1.3150800              0.8963990              0.6069070        
L   2
  1      0.6113490             -0.3611010              0.0242633        
  2      0.1418410              1.2150500              0.9866730        
L   1
  1      0.0464011              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: Al
data:
ALUMINUM
S   3
  1    775.7370000              0.0668347        
  2    116.9520000              0.3890610        
  3     25.3326000              0.6694680        
L   3
  1     29.4796000             -0.1079020              0.1175740        
  2      6.6331400              0.1462450              0.4611740        
  3      1.7267500              0.9237300              0.6055350        
L   2
  1      0.9461600             -0.3203270              0.0519383        
  2      0.2025060              1.1841200              0.9726600        
L   1
  1      0.0639088              1.0000000              1.0000000        
D   1
  1      0.3250000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: Si
data:
SILICON
S   3
  1    910.6550000              0.0660823        
  2    137.3360000              0.3862290        
  3     29.7601000              0.6723800        
L   3
  1     36.6716000             -0.1045110              0.1133550        
  2      8.3172900              0.1074100              0.4575780        
  3      2.2164500              0.9514460              0.6074270        
L   2
  1      1.0791300             -0.3761080              0.0671030        
  2      0.3024220              1.2516500              0.9568830        
L   1
  1      0.0933392              1.0000000              1.0000000        
D   1
  1      0.4500000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: P
data:
PHOSPHORUS
S   3
  1   1054.9000000              0.0655410        
  2    159.1950000              0.3840360        
  3     34.5304000              0.6745410        
L   3
  1     44.2866000             -0.1021300              0.1108510        
  2     10.1019000              0.0815920              0.4564950        
  3      2.7399700              0.9697880              0.6069360        
L   2
  1      1.2186500             -0.3714950              0.0915820        
  2      0.3955460              1.2709900              0.9349240        
L   1
  1      0.1228110              1.0000000              1.0000000        
D   1
  1      0.5500000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: S
data:
SULFUR
S   3
  1   1210.6200000              0.0650070        
  2    182.7470000              0.3820400        
  3     39.6673000              0.6765450        
L   3
  1     52.2236000             -0.1003100              0.1096460        
  2     11.9629000              0.0650880              0.4576490        
  3      3.2891100              0.9814550              0.6042610        
L   2
  1      1.2238400             -0.2860890              0.1647770        
  2      0.4573030              1.2280600              0.8708550        
L   1
  1      0.1422690              1.0000000              1.0000000        
D   1
  1      0.6500000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: Cl
data:
CHLORINE
S   3
  1   1376.4000000              0.0645827        
  2    207.8570000              0.3803630        
  3     45.1554000              0.6781900        
L   3
  1     60.8014000             -0.0987639              0.1085980        
  2     13.9765000              0.0511338              0.4586820        
  3      3.8871000              0.9913370              0.6019620        
L   2
  1      1.3529900             -0.2224010              0.2192160        
  2      0.5269550              1.1825200              0.8223210        
L   1
  1      0.1667140              1.0000000              1.0000000        
D   1
  1      0.7500000              1.0000000


name: 3-21G*
description: VDZP Valence Double Zeta + Polarization on Second Row Atoms
elt: Ar
data:
ARGON
S   3
  1   1553.7100000              0.0641707        
  2    234.6780000              0.3787970        
  3     51.0121000              0.6797520        
L   3
  1     70.0453000             -0.0974661              0.1076190        
  2     16.1473000              0.0390569              0.4595760        
  3      4.5349200              0.9999160              0.6000410        
L   2
  1      1.5420900             -0.1768660              0.2556870        
  2      0.6072670              1.1469000              0.7898420        
L   1
  1      0.1953730              1.0000000              1.0000000        
D   1
  1      0.8500000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: Na
data:
SODIUM
S   3
  1    547.6130000              0.0674911        
  2     82.0678000              0.3935050        
  3     17.6917000              0.6656050        
L   3
  1     17.5407000             -0.1119370              0.1282330        
  2      3.7939800              0.2546540              0.4715330        
  3      0.9064410              0.8444170              0.6042730        
L   2
  1      0.5018240             -0.2196600              0.0090665        
  2      0.0609458              1.0891200              0.9972020        
L   1
  1      0.0244349              1.0000000              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: Mg
data:
MAGNESIUM
S   3
  1    652.8410000              0.0675982        
  2     98.3805000              0.3917780        
  3     21.2996000              0.6666610        
L   3
  1     23.3727000             -0.1102460              0.1210140        
  2      5.1995300              0.1841190              0.4628100        
  3      1.3150800              0.8963990              0.6069070        
L   2
  1      0.6113490             -0.3611010              0.0242633        
  2      0.1418410              1.2150500              0.9866730        
L   1
  1      0.0464011              1.0000000              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: Al
data:
ALUMINUM
S   3
  1    775.7370000              0.0668347        
  2    116.9520000              0.3890610        
  3     25.3326000              0.6694680        
L   3
  1     29.4796000             -0.1079020              0.1175740        
  2      6.6331400              0.1462450              0.4611740        
  3      1.7267500              0.9237300              0.6055350        
L   2
  1      0.9461600             -0.3203270              0.0519383        
  2      0.2025060              1.1841200              0.9726600        
L   1
  1      0.0639088              1.0000000              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000        
D   1
  1      0.3250000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: Si
data:
SILICON
S   3
  1    910.6550000              0.0660823        
  2    137.3360000              0.3862290        
  3     29.7601000              0.6723800        
L   3
  1     36.6716000             -0.1045110              0.1133550        
  2      8.3172900              0.1074100              0.4575780        
  3      2.2164500              0.9514460              0.6074270        
L   2
  1      1.0791300             -0.3761080              0.0671030        
  2      0.3024220              1.2516500              0.9568830        
L   1
  1      0.0933392              1.0000000              1.0000000        
L   1
  1      0.0331000              1.0000000              1.0000000        
D   1
  1      0.4500000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: P
data:
PHOSPHORUS
S   3
  1   1054.9000000              0.0655410        
  2    159.1950000              0.3840360        
  3     34.5304000              0.6745410        
L   3
  1     44.2866000             -0.1021300              0.1108510        
  2     10.1019000              0.0815920              0.4564950        
  3      2.7399700              0.9697880              0.6069360        
L   2
  1      1.2186500             -0.3714950              0.0915820        
  2      0.3955460              1.2709900              0.9349240        
L   1
  1      0.1228110              1.0000000              1.0000000        
L   1
  1      0.0348000              1.0000000              1.0000000        
D   1
  1      0.5500000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: S
data:
SULFUR
S   3
  1   1210.6200000              0.0650070        
  2    182.7470000              0.3820400        
  3     39.6673000              0.6765450        
L   3
  1     52.2236000             -0.1003100              0.1096460        
  2     11.9629000              0.0650880              0.4576490        
  3      3.2891100              0.9814550              0.6042610        
L   2
  1      1.2238400             -0.2860890              0.1647770        
  2      0.4573030              1.2280600              0.8708550        
L   1
  1      0.1422690              1.0000000              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      0.6500000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: Cl
data:
CHLORINE
S   3
  1   1376.4000000              0.0645827        
  2    207.8570000              0.3803630        
  3     45.1554000              0.6781900        
L   3
  1     60.8014000             -0.0987639              0.1085980        
  2     13.9765000              0.0511338              0.4586820        
  3      3.8871000              0.9913370              0.6019620        
L   2
  1      1.3529900             -0.2224010              0.2192160        
  2      0.5269550              1.1825200              0.8223210        
L   1
  1      0.1667140              1.0000000              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      0.7500000              1.0000000


name: 3-21++G*
description: VDZD Valence Double Zeta + Diffuse Functions + Polarization
elt: Ar
data:
ARGON
S   3
  1   1553.7100000              0.0641707        
  2    234.6780000              0.3787970        
  3     51.0121000              0.6797520        
L   3
  1     70.0453000             -0.0974661              0.1076190        
  2     16.1473000              0.0390569              0.4595760        
  3      4.5349200              0.9999160              0.6000410        
L   2
  1      1.5420900             -0.1768660              0.2556870        
  2      0.6072670              1.1469000              0.7898420        
L   1
  1      0.1953730              1.0000000              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000        
D   1
  1      0.8500000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: H
data:
HYDROGEN
S   3
  1     18.7311370              0.0334946        
  2      2.8253944              0.2347269        
  3      0.6401217              0.8137573        
S   1
  1      0.1612778              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: He
data:
HELIUM
S   3
  1     38.4216340              0.0237660        
  2      5.7780300              0.1546790        
  3      1.2417740              0.4696300        
S   1
  1      0.2979640              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Li
data:
LITHIUM
S   5
  1    275.3944400              0.00612185       
  2     41.4351750              0.04511296       
  3      9.3669938              0.19269415       
  4      2.5377253              0.46854421       
  5      0.7466365              0.44060752       
L   2
  1      0.7345643             -0.25253680             0.14359173       
  2      0.0871980              1.09734080             0.94780305       
L   1
  1      0.0404387              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Be
data:
BERYLLIUM
S   5
  1    554.0100000              0.00540997       
  2     83.2631000              0.04025150       
  3     18.8635000              0.17685800       
  4      5.1778200              0.45255900       
  5      1.5560200              0.47029300       
L   2
  1      1.4417524910          -0.4774290              0.2011420        
  2      0.3018610597           1.2474500              0.8844830        
L   1
  1      0.1009613875           1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: B
data:
BORON
S   4
  1    330.7528500              0.0179942        
  2     49.8438650              0.1246937        
  3     11.1170540              0.4343354        
  4      2.9227243              0.5609794        
L   3
  1      5.6812646             -0.1303871              0.0637429        
  2      1.4544046             -0.2514344              0.2761331        
  3      0.4283786              1.2051292              0.7773866        
L   1
  1      0.1442192              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: C
data:
CARBON
S   4
  1    486.9669300              0.0177258        
  2     73.3710940              0.1234787        
  3     16.4134580              0.4338754        
  4      4.3449836              0.5615042        
L   3
  1      8.6735253             -0.1213837              0.0635454        
  2      2.0966193             -0.2273385              0.2982678        
  3      0.6046513              1.1851739              0.7621032        
L   1
  1      0.1835578              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: N
data:
NITROGEN
S   4
  1    671.2795000              0.0175982511     
  2    101.2017000              0.1228462410     
  3     22.6999700              0.4337821410     
  4      6.0406090              0.5614182170     
L   3
  1     12.3935997             -0.1174892990           0.0640203443     
  2      2.9223828             -0.2139940160           0.3112025550     
  3      0.83252808             1.1745021100           0.7527482390     
L   1
  1      0.2259640              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: O
data:
OXYGEN
S   4
  1    883.2728600              0.0175506        
  2    133.1292800              0.1228292        
  3     29.9064080              0.4348836        
  4      7.9786772              0.5600108        
L   3
  1     16.1944470             -0.1134010              0.0685453        
  2      3.7800860             -0.1772865              0.3312254        
  3      1.0709836              1.1504079              0.7346079        
L   1
  1      0.2838798              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: F
data:
FLUORINE
S   4
  1   1126.1630000              0.0174758        
  2    169.7432000              0.1225230        
  3     38.1815100              0.4349990        
  4     10.2120400              0.5598120        
L   3
  1     21.4953700             -0.1110570              0.0698880        
  2      4.9897780             -0.1683220              0.3393880        
  3      1.4035740              1.1436260              0.7279590        
L   1
  1      0.3730318              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ne
data:
NEON
S   4
  1   1397.9321000              0.017423805      
  2    210.7697800              0.122272745      
  3     47.4672570              0.435014232      
  4     12.7226260              0.559714642      
L   3
  1     27.2130330             -0.109609439            0.070440307      
  2      6.2941344             -0.164124890            0.343993047      
  3      1.7600513              1.140151590            0.724514960      
L   1
  1      0.4618670              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: P
data:
PHOSPHORUS
S   4
  1   3018.6718000              0.0185213137     
  2    455.1271210              0.129904864      
  3    102.3147300              0.455100288      
  4     27.61784730             0.533131861      
L   4
  1    114.4294010             -0.0247502961           0.0274140025     
  2     26.58229590            -0.1350924600           0.169079142      
  3      7.871888900            0.2277360800           0.469102089      
  4      2.487857250            0.8755931160           0.518153059      
L   3
  1     50.75061900            -0.045119223            0.00377907118    
  2      1.672862420           -0.850472990           -0.04634384050    
  3      0.621097412            1.596285850            1.03394429000    
L   1
  1      0.167016007            1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: S
data:
SULFUR
S   4
  1   3442.1244000              0.0184921        
  2    518.9131000              0.1298220        
  3    116.6909000              0.4550418        
  4     31.5716470              0.5330084        
L   4
  1    127.4405800             -0.0272646              0.0291520        
  2     29.7476670             -0.1424834              0.1779597        
  3      8.8346642              0.2597043              0.4836237        
  4      2.8173898              0.8525473              0.4942553        
L   3
  1      3.7291854             -0.2775315             -0.0337509        
  2      1.4067702             -0.4576435              0.1457110        
  3      0.5481100              1.4316843              0.8982887        
L   1
  1      0.1703809              1.0000000              1.0000000


name: 4-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cl
data:
CHLORINE
S   4
  1   3910.3026000              0.0183794        
  2    589.5518000              0.1291401        
  3    132.5939200              0.4540448        
  4     35.9035420              0.5344394        
L   4
  1    147.7653500             -0.0267433              0.0288645        
  2     34.5060750             -0.1446911              0.1779647        
  3     10.2864710              0.2517035              0.4869998        
  4      3.3111473              0.8598203              0.4890184        
L   3
  1      4.280284910           -0.2703963             -0.0367028        
  2      1.641016670           -0.3416297              0.1918492        
  3      0.614478503            1.3500245              0.8643376        
L   1
  1      0.195659411            1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: H
data:
HYDROGEN
S   2
  1      5.4471780              0.1562850        
  2      0.8245470              0.9046910        
S   1
  1      0.1831920              1.0000000        
S   1
  1      0.0360000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Li
data:
LITHIUM
S   3
  1     36.8382000              0.0696686        
  2      5.4817200              0.3813460        
  3      1.1132700              0.6817020        
L   2
  1      0.5402050             -0.2631270              0.1615460        
  2      0.1022550              1.1433900              0.9156630        
L   1
  1      0.0285650              1.0000000              1.0000000        
L   1
  1      0.0074000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Be
data:
BERYLLIUM
S   3
  1     71.8876000              0.0644263        
  2     10.7289000              0.3660960        
  3      2.2220500              0.6959340        
L   2
  1      1.2954800             -0.4210640              0.2051320        
  2      0.2688810              1.2240700              0.8825280        
L   1
  1      0.0773500              1.0000000              1.0000000        
L   1
  1      0.0207000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: B
data:
BORON
S   3
  1    116.4340000              0.0629605        
  2     17.4314000              0.3633040        
  3      3.6801600              0.6972550        
L   2
  1      2.2818700             -0.3686620              0.2311520        
  2      0.4652480              1.1994400              0.8667640        
L   1
  1      0.1243280              1.0000000              1.0000000        
L   1
  1      0.0315000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: C
data:
CARBON
S   3
  1    172.2560000              0.0617669        
  2     25.9109000              0.3587940        
  3      5.5333500              0.7007130        
L   2
  1      3.6649800             -0.3958970              0.2364600        
  2      0.7705450              1.2158400              0.8606190        
L   1
  1      0.1958570              1.0000000              1.0000000        
L   1
  1      0.0438000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: N
data:
NITROGEN
S   3
  1    242.7660000              0.0598657        
  2     36.4851000              0.3529550        
  3      7.8144900              0.7065130        
L   2
  1      5.4252200             -0.4133010              0.2379720        
  2      1.1491500              1.2244200              0.8589530        
L   1
  1      0.2832050              1.0000000              1.0000000        
L   1
  1      0.0639000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: O
data:
OXYGEN
S   3
  1    322.0370000              0.0592394        
  2     48.4308000              0.3515000        
  3     10.4206000              0.7076580        
L   2
  1      7.4029400             -0.4044530              0.2445860        
  2      1.5762000              1.2215600              0.8539550        
L   1
  1      0.3736840              1.0000000              1.0000000        
L   1
  1      0.0845000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: F
data:
FLUORINE
S   3
  1    413.8010000              0.0585483        
  2     62.2446000              0.3493080        
  3     13.4340000              0.7096320        
L   2
  1      9.7775900             -0.4073270              0.2466800        
  2      2.0861700              1.2231400              0.8523210        
L   1
  1      0.4823830              1.0000000              1.0000000        
L   1
  1      0.1076000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ne
data:
NEON
S   3
  1    515.7240000              0.0581430        
  2     77.6538000              0.3479510        
  3     16.8136000              0.7107140        
L   2
  1     12.4830000             -0.4099220              0.2474600        
  2      2.6645100              1.2243100              0.8517430        
L   1
  1      0.6062500              1.0000000              1.0000000        
L   1
  1      0.1300000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Na
data:
SODIUM
S   3
  1    547.6130000              0.0674911        
  2     82.0678000              0.3935050        
  3     17.6917000              0.6656050        
L   3
  1     17.5407000             -0.1119370              0.1282330        
  2      3.7939800              0.2546540              0.4715330        
  3      0.9064410              0.8444170              0.6042730        
L   2
  1      0.5018240             -0.2196600              0.0090665        
  2      0.0609458              1.0891200              0.9972020        
L   1
  1      0.0244349              1.0000000              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Mg
data:
MAGNESIUM
S   3
  1    652.8410000              0.0675982        
  2     98.3805000              0.3917780        
  3     21.2996000              0.6666610        
L   3
  1     23.3727000             -0.1102460              0.1210140        
  2      5.1995300              0.1841190              0.4628100        
  3      1.3150800              0.8963990              0.6069070        
L   2
  1      0.6113490             -0.3611010              0.0242633        
  2      0.1418410              1.2150500              0.9866730        
L   1
  1      0.0464011              1.0000000              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Al
data:
ALUMINUM
S   3
  1    775.7370000              0.0668347        
  2    116.9520000              0.3890610        
  3     25.3326000              0.6694680        
L   3
  1     29.4796000             -0.1079020              0.1175740        
  2      6.6331400              0.1462450              0.4611740        
  3      1.7267500              0.9237300              0.6055350        
L   2
  1      0.9461600             -0.3203270              0.0519383        
  2      0.2025060              1.1841200              0.9726600        
L   1
  1      0.0639088              1.0000000              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Si
data:
SILICON
S   3
  1    910.6550000              0.0660823        
  2    137.3360000              0.3862290        
  3     29.7601000              0.6723800        
L   3
  1     36.6716000             -0.1045110              0.1133550        
  2      8.3172900              0.1074100              0.4575780        
  3      2.2164500              0.9514460              0.6074270        
L   2
  1      1.0791300             -0.3761080              0.0671030        
  2      0.3024220              1.2516500              0.9568830        
L   1
  1      0.0933392              1.0000000              1.0000000        
L   1
  1      0.0331000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: P
data:
PHOSPHORUS
S   3
  1   1054.9000000              0.0655410        
  2    159.1950000              0.3840360        
  3     34.5304000              0.6745410        
L   3
  1     44.2866000             -0.1021300              0.1108510        
  2     10.1019000              0.0815920              0.4564950        
  3      2.7399700              0.9697880              0.6069360        
L   2
  1      1.2186500             -0.3714950              0.0915820        
  2      0.3955460              1.2709900              0.9349240        
L   1
  1      0.1228110              1.0000000              1.0000000        
L   1
  1      0.0348000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: S
data:
SULFUR
S   3
  1   1210.6200000              0.0650070        
  2    182.7470000              0.3820400        
  3     39.6673000              0.6765450        
L   3
  1     52.2236000             -0.1003100              0.1096460        
  2     11.9629000              0.0650880              0.4576490        
  3      3.2891100              0.9814550              0.6042610        
L   2
  1      1.2238400             -0.2860890              0.1647770        
  2      0.4573030              1.2280600              0.8708550        
L   1
  1      0.1422690              1.0000000              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Cl
data:
CHLORINE
S   3
  1   1376.4000000              0.0645827        
  2    207.8570000              0.3803630        
  3     45.1554000              0.6781900        
L   3
  1     60.8014000             -0.0987639              0.1085980        
  2     13.9765000              0.0511338              0.4586820        
  3      3.8871000              0.9913370              0.6019620        
L   2
  1      1.3529900             -0.2224010              0.2192160        
  2      0.5269550              1.1825200              0.8223210        
L   1
  1      0.1667140              1.0000000              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ar
data:
ARGON
S   3
  1   1553.7100000              0.0641707        
  2    234.6780000              0.3787970        
  3     51.0121000              0.6797520        
L   3
  1     70.0453000             -0.0974661              0.1076190        
  2     16.1473000              0.0390569              0.4595760        
  3      4.5349200              0.9999160              0.6000410        
L   2
  1      1.5420900             -0.1768660              0.2556870        
  2      0.6072670              1.1469000              0.7898420        
L   1
  1      0.1953730              1.0000000              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: K
data:
POTASSIUM
S   3
  1   1721.1755000              0.0648747        
  2    260.0163300              0.3808593        
  3     56.6245540              0.6773681        
L   3
  1     71.5572000             -0.1093429              0.1339654        
  2     15.4389400              0.1130640              0.5302673        
  3      4.4745510              0.9462575              0.5117992        
L   3
  1      4.1212750             -0.2699730              0.01994922       
  2      1.1886210              0.3646323              0.43402130       
  3      0.3756740              0.8107533              0.64532260       
L   2
  1      0.2445770             -0.2688250              0.0003081035     
  2      0.0389720              1.1289830              0.9998787        
L   1
  1      0.0160630              1.0000000              1.0000000        
L   1
  1      0.0047000              1.0000000              1.0000000


name: 3-21++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ca
data:
CALCIUM
S   3
  1   1915.4348000              0.0646240        
  2    289.5332400              0.3798380        
  3     63.1063520              0.6783290        
L   3
  1     80.3974400             -0.1093030              0.1354330        
  2     17.3307500              0.1089000              0.5372220        
  3      5.0836240              0.9492770              0.5018040        
L   3
  1      4.7822290             -0.2816070              0.0190090        
  2      1.4625580              0.3410510              0.4360380        
  3      0.4792230              0.8381040              0.6386710        
L   2
  1      0.4396820             -0.2697050              0.0003080        
  2      0.0591300              1.1132930              0.9998960        
L   1
  1      0.0238970              1.0000000              1.0000000        
L   1
  1      0.0071000              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: H
data:
HYDROGEN
S   2
  1      5.4471780              0.1562850        
  2      0.8245470              0.9046910        
S   1
  1      0.1831920              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: He
data:
HELIUM
S   2
  1     13.6267000              0.1752300        
  2      1.9993500              0.8934830        
S   1
  1      0.3829930              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Li
data:
LITHIUM
S   3
  1     36.8382000              0.0696686        
  2      5.4817200              0.3813460        
  3      1.1132700              0.6817020        
L   2
  1      0.5402050             -0.2631270              0.1615460        
  2      0.1022550              1.1433900              0.9156630        
L   1
  1      0.0285650              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Be
data:
BERYLLIUM
S   3
  1     71.8876000              0.0644263        
  2     10.7289000              0.3660960        
  3      2.2220500              0.6959340        
L   2
  1      1.2954800             -0.4210640              0.2051320        
  2      0.2688810              1.2240700              0.8825280        
L   1
  1      0.0773500              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: B
data:
BORON
S   3
  1    116.4340000              0.0629605        
  2     17.4314000              0.3633040        
  3      3.6801600              0.6972550        
L   2
  1      2.2818700             -0.3686620              0.2311520        
  2      0.4652480              1.1994400              0.8667640        
L   1
  1      0.1243280              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: C
data:
CARBON
S   3
  1    172.2560000              0.0617669        
  2     25.9109000              0.3587940        
  3      5.5333500              0.7007130        
L   2
  1      3.6649800             -0.3958970              0.2364600        
  2      0.7705450              1.2158400              0.8606190        
L   1
  1      0.1958570              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: N
data:
NITROGEN
S   3
  1    242.7660000              0.0598657        
  2     36.4851000              0.3529550        
  3      7.8144900              0.7065130        
L   2
  1      5.4252200             -0.4133010              0.2379720        
  2      1.1491500              1.2244200              0.8589530        
L   1
  1      0.2832050              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: O
data:
OXYGEN
S   3
  1    322.0370000              0.0592394        
  2     48.4308000              0.3515000        
  3     10.4206000              0.7076580        
L   2
  1      7.4029400             -0.4044530              0.2445860        
  2      1.5762000              1.2215600              0.8539550        
L   1
  1      0.3736840              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: F
data:
FLUORINE
S   3
  1    413.8010000              0.0585483        
  2     62.2446000              0.3493080        
  3     13.4340000              0.7096320        
L   2
  1      9.7775900             -0.4073270              0.2466800        
  2      2.0861700              1.2231400              0.8523210        
L   1
  1      0.4823830              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ne
data:
NEON
S   3
  1    515.7240000              0.0581430        
  2     77.6538000              0.3479510        
  3     16.8136000              0.7107140        
L   2
  1     12.4830000             -0.4099220              0.2474600        
  2      2.6645100              1.2243100              0.8517430        
L   1
  1      0.6062500              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Na
data:
SODIUM
S   3
  1    547.6130000              0.0674911        
  2     82.0678000              0.3935050        
  3     17.6917000              0.6656050        
L   3
  1     17.5407000             -0.1119370              0.1282330        
  2      3.7939800              0.2546540              0.4715330        
  3      0.9064410              0.8444170              0.6042730        
L   2
  1      0.5018240             -0.2196600              0.0090665        
  2      0.0609458              1.0891200              0.9972020        
L   1
  1      0.0244349              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Mg
data:
MAGNESIUM
S   3
  1    652.8410000              0.0675982        
  2     98.3805000              0.3917780        
  3     21.2996000              0.6666610        
L   3
  1     23.3727000             -0.1102460              0.1210140        
  2      5.1995300              0.1841190              0.4628100        
  3      1.3150800              0.8963990              0.6069070        
L   2
  1      0.6113490             -0.3611010              0.0242633        
  2      0.1418410              1.2150500              0.9866730        
L   1
  1      0.0464011              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Al
data:
ALUMINUM
S   3
  1    775.7370000              0.0668347        
  2    116.9520000              0.3890610        
  3     25.3326000              0.6694680        
L   3
  1     29.4796000             -0.1079020              0.1175740        
  2      6.6331400              0.1462450              0.4611740        
  3      1.7267500              0.9237300              0.6055350        
L   2
  1      0.9461600             -0.3203270              0.0519383        
  2      0.2025060              1.1841200              0.9726600        
L   1
  1      0.0639088              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Si
data:
SILICON
S   3
  1    910.6550000              0.0660823        
  2    137.3360000              0.3862290        
  3     29.7601000              0.6723800        
L   3
  1     36.6716000             -0.1045110              0.1133550        
  2      8.3172900              0.1074100              0.4575780        
  3      2.2164500              0.9514460              0.6074270        
L   2
  1      1.0791300             -0.3761080              0.0671030        
  2      0.3024220              1.2516500              0.9568830        
L   1
  1      0.0933392              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: P
data:
PHOSPHORUS
S   3
  1   1054.9000000              0.0655410        
  2    159.1950000              0.3840360        
  3     34.5304000              0.6745410        
L   3
  1     44.2866000             -0.1021300              0.1108510        
  2     10.1019000              0.0815920              0.4564950        
  3      2.7399700              0.9697880              0.6069360        
L   2
  1      1.2186500             -0.3714950              0.0915820        
  2      0.3955460              1.2709900              0.9349240        
L   1
  1      0.1228110              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: S
data:
SULFUR
S   3
  1   1210.6200000              0.0650070        
  2    182.7470000              0.3820400        
  3     39.6673000              0.6765450        
L   3
  1     52.2236000             -0.1003100              0.1096460        
  2     11.9629000              0.0650880              0.4576490        
  3      3.2891100              0.9814550              0.6042610        
L   2
  1      1.2238400             -0.2860890              0.1647770        
  2      0.4573030              1.2280600              0.8708550        
L   1
  1      0.1422690              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cl
data:
CHLORINE
S   3
  1   1376.4000000              0.0645827        
  2    207.8570000              0.3803630        
  3     45.1554000              0.6781900        
L   3
  1     60.8014000             -0.0987639              0.1085980        
  2     13.9765000              0.0511338              0.4586820        
  3      3.8871000              0.9913370              0.6019620        
L   2
  1      1.3529900             -0.2224010              0.2192160        
  2      0.5269550              1.1825200              0.8223210        
L   1
  1      0.1667140              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ar
data:
ARGON
S   3
  1   1553.7100000              0.0641707        
  2    234.6780000              0.3787970        
  3     51.0121000              0.6797520        
L   3
  1     70.0453000             -0.0974661              0.1076190        
  2     16.1473000              0.0390569              0.4595760        
  3      4.5349200              0.9999160              0.6000410        
L   2
  1      1.5420900             -0.1768660              0.2556870        
  2      0.6072670              1.1469000              0.7898420        
L   1
  1      0.1953730              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: K
data:
POTASSIUM
S   3
  1   1721.1755000              0.0648747        
  2    260.0163300              0.3808593        
  3     56.6245540              0.6773681        
L   3
  1     71.5572000             -0.1093429              0.1339654        
  2     15.4389400              0.1130640              0.5302673        
  3      4.4745510              0.9462575              0.5117992        
L   3
  1      4.1212750             -0.2699730              0.01994922       
  2      1.1886210              0.3646323              0.43402130       
  3      0.3756740              0.8107533              0.64532260       
L   2
  1      0.2445770             -0.2688250              0.0003081035     
  2      0.0389720              1.1289830              0.9998787        
L   1
  1      0.0160630              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ca
data:
CALCIUM
S   3
  1   1915.4348000              0.0646240        
  2    289.5332400              0.3798380        
  3     63.1063520              0.6783290        
L   3
  1     80.3974400             -0.1093030              0.1354330        
  2     17.3307500              0.1089000              0.5372220        
  3      5.0836240              0.9492770              0.5018040        
L   3
  1      4.7822290             -0.2816070              0.0190090        
  2      1.4625580              0.3410510              0.4360380        
  3      0.4792230              0.8381040              0.6386710        
L   2
  1      0.4396820             -0.2697050              0.0003080        
  2      0.0591300              1.1132930              0.9998960        
L   1
  1      0.0238970              1.0000000              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Sc
data:
SCANDIUM
S   3
  1   2119.8870000              0.0644210        
  2    320.4299000              0.3791600        
  3     69.8989300              0.6789630        
L   3
  1     89.7645000             -0.1093840              0.1363280        
  2     19.3851000              0.1050700              0.5418600        
  3      5.7314230              0.9522050              0.4950550        
L   3
  1      5.4919380             -0.2852110              0.0176140        
  2      1.7437420              0.3241550              0.4336450        
  3      0.5662270              0.8565920              0.6425510        
L   2
  1      0.5168020             -0.2626780              0.0003270        
  2      0.0672140              1.1080790              0.9998930        
L   1
  1      0.0259850              1.0000000              1.0000000        
D   2
  1      5.7222150              0.2652360        
  2      1.3608490              0.8558610        
D   1
  1      0.3226520              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ti
data:
TITANIUM
S   3
  1   2335.0200000              0.0642170        
  2    353.0441000              0.3784120        
  3     77.0584500              0.6796810        
L   3
  1     99.5738700             -0.1094720              0.1372970        
  2     21.5467100              0.1019430              0.5458750        
  3      6.4139650              0.9546220              0.4890680        
L   3
  1      6.2382790             -0.2861370              0.0192370        
  2      1.9961080              0.3218280              0.4404420        
  3      0.6464900              0.8595510              0.6356200        
L   2
  1      0.5732850             -0.2424500              0.0002920        
  2      0.0731190              1.1000750              0.9999070        
L   1
  1      0.0265380              1.0000000              1.0000000        
D   2
  1      7.0836660              0.2629210        
  2      1.7096340              0.8557720        
D   1
  1      0.4141230              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: V
data:
VANADIUM
S   3
  1   2563.8770000              0.0639480        
  2    387.5340000              0.3775940        
  3     84.5982300              0.6805420        
L   3
  1    109.7938000             -0.1098360              0.1384210        
  2     23.7692100              0.1007070              0.5504890        
  3      7.1229610              0.9556330              0.4824170        
L   3
  1      6.9812040             -0.2884590              0.0218210        
  2      2.2198390              0.3364360              0.4567620        
  3      0.7198030              0.8481900              0.6186750        
L   2
  1      0.6312620             -0.2364900              0.0001900        
  2      0.0800620              1.0977210              0.9999400        
L   1
  1      0.0288650              1.0000000              1.0000000        
D   2
  1      8.3429170              0.2640620        
  2      2.0329440              0.8539660        
D   1
  1      0.4957120              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cr
data:
CHROMIUM
S   3
  1   2798.2940000              0.0638240        
  2    423.1370000              0.3770840        
  3     92.4388600              0.6809890        
L   3
  1    120.2806000             -0.1177790              0.1398780        
  2     26.0372700              0.1014310              0.5559830        
  3      7.8441720              0.9571980              0.4748180        
L   3
  1      7.7932760             -0.2888570              0.0221850        
  2      2.4971960              0.3351150              0.4616250        
  3      0.8051420              0.8502480              0.6145390        
L   2
  1      0.7039210             -0.2322510              0.0001800        
  2      0.0861620              1.0936710              0.9999450        
L   1
  1      0.0321990              1.0000000              1.0000000        
D   2
  1      9.6253390              0.2655960        
  2      2.3622640              0.8521560        
D   1
  1      0.5770940              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Mn
data:
MANGANESE
S   3
  1   3041.6860000              0.0637450        
  2    460.0901000              0.3767490        
  3    100.5958000              0.6812470        
L   3
  1    131.7673000             -0.1102960              0.1404540        
  2     28.5691500              0.0981900              0.5578020        
  3      8.6605010              0.9576590              0.4715010        
L   3
  1      8.5690810             -0.2917140              0.0242240        
  2      2.7681780              0.3439630              0.4686600        
  3      0.8872880              0.8451980              0.6074210        
L   2
  1      0.7674430             -0.2300040              0.0003080        
  2      0.0920250              1.0914500              0.9999070        
L   1
  1      0.0332650              1.0000000              1.0000000        
D   2
  1     11.0688400              0.2652720        
  2      2.7307070              0.8517950        
D   1
  1      0.6685090              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Fe
data:
IRON
S   3
  1   3299.1840000              0.0635860        
  2    499.0886000              0.3762020        
  3    109.1614000              0.6817850        
L   3
  1    143.4652000             -0.1105520              0.1411010        
  2     31.1685800              0.0968470              0.5603870        
  3      9.4836120              0.9587970              0.4676440        
L   3
  1      9.4645650             -0.2920560              0.0237620        
  2      3.1003730              0.3375240              0.4689110        
  3      0.9864930              0.8519420              0.6083110        
L   2
  1      0.8534120             -0.2279440             -0.0004260        
  2      0.0988120              1.0882870              1.0001240        
L   1
  1      0.0364420              1.0000000              1.0000000        
D   2
  1     12.3544900              0.2686110        
  2      3.0556050              0.8492720        
D   1
  1      0.7385910              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Co
data:
COBALT
S   3
  1   3564.7620000              0.0634870        
  2    539.3908000              0.3758180        
  3    118.0449000              0.6821220        
L   3
  1    155.4382000             -0.1109870              0.1420640        
  2     33.8156100              0.0967670              0.5634440        
  3     10.3332300              0.9589920              0.4630240        
L   3
  1     10.3815200             -0.2922620              0.0263130        
  2      3.3827140              0.3432510              0.4769170        
  3      1.0769540              0.8469630              0.5991540        
L   2
  1      0.9090150             -0.2174600              0.0002280        
  2      0.1050410              1.0849980              0.9999340        
L   1
  1      0.0372570              1.0000000              1.0000000        
D   2
  1     13.7407000              0.2709550        
  2      3.4089830              0.8473420        
D   1
  1      0.8186410              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ni
data:
NICKEL
S   3
  1   3848.0050000              0.0632660        
  2    582.0307000              0.3751710        
  3    127.3674000              0.6828240        
L   3
  1    168.2896000             -0.1111150              0.1424900        
  2     36.6563300              0.0953240              0.5655470        
  3     11.2321200              0.9601610              0.4599930        
L   3
  1     11.3587700             -0.2920600              0.0261380        
  2      3.7388460              0.3375410              0.4765980        
  3      1.1824630              0.8525330              0.6003800        
L   2
  1      0.9889040             -0.2136870              0.0002940        
  2      0.1110250              1.0819330              0.9999170        
L   1
  1      0.0392580              1.0000000              1.0000000        
D   2
  1     15.2206900              0.2726060        
  2      3.7860200              0.8459280        
D   1
  1      0.9045570              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cu
data:
COPPER
S   3
  1   4134.3020000              0.0631880        
  2    625.4912000              0.3748450        
  3    136.9556000              0.6831000        
L   3
  1    181.4960000             -0.1113200              0.1430840        
  2     39.5743100              0.0944870              0.5677560        
  3     12.1624600              0.9608790              0.4567140        
L   3
  1     12.3511100             -0.2922230              0.0277270        
  2      4.0496510              0.3429910              0.4835240        
  3      1.2792250              0.8479460              0.5929780        
L   2
  1      1.0498040             -0.2065080              0.0001390        
  2      0.1169330              1.0792730              0.9999610        
L   1
  1      0.0007510              1.0000000              1.0000000        
D   2
  1     16.7593800              0.2741120        
  2      4.1789770              0.8446250        
D   1
  1      0.9943270              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Zn
data:
ZINC
S   3
  1   4432.2880000              0.0630930        
  2    670.6601000              0.3745040        
  3    146.9024000              0.6834160        
L   3
  1    195.0042000             -0.1116280              0.1438060        
  2     42.5688900              0.0943360              0.5700020        
  3     13.1214300              0.9611000              0.4533120        
L   3
  1     13.4023100             -0.2917810              0.0287050        
  2      4.3999060              0.3426140              0.4862520        
  3      1.3851480              0.8482840              0.5902350        
L   2
  1      1.1215580             -0.2023710              0.0003440        
  2      0.1229440              1.0770350              0.9999050        
L   1
  1      0.0421930              1.0000000              1.0000000        
D   2
  1     18.3682000              0.2753860        
  2      4.5913040              0.8434770        
D   1
  1      1.0902030              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ga
data:
GALLIUM
S   3
  1   4751.8979000              0.0628400        
  2    718.9205400              0.3736110        
  3    157.4459200              0.6843630        
L   3
  1    209.5834000             -0.1115160              0.1442660        
  2     45.6917100              0.0926960              0.5731780        
  3     14.1329700              0.9622870              0.4490860        
L   3
  1     14.5995400              0.2910290              0.0265620        
  2      4.8608420             -0.3231880              0.4833140        
  3      1.5491110             -0.8643910              0.5924300        
L   2
  1      1.2679430             -0.2851310              0.0301830        
  2      0.1883990              1.1280220              0.9884660        
L   1
  1      0.0572370              1.0000000              1.0000000        
D   3
  1     21.2925300              0.1619900        
  2      5.3931660              0.5116740        
  3      1.3338830              0.5898730


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ge
data:
GERMANIUM
S   3
  1   5073.7499000              0.0627250        
  2    767.7241700              0.3731670        
  3    168.1888100              0.6847870        
L   3
  1    224.4360000             -0.1115150              0.1446400        
  2     48.9554300              0.0912000              0.5753800        
  3     15.1837000              0.9634490              0.4459950        
L   3
  1     15.9125700             -0.2895650              0.0229730        
  2      5.4414370              0.2938830              0.4732450        
  3      1.7426030              0.8891990              0.6032780        
L   2
  1      1.4665380             -0.3967340              0.0278930        
  2      0.2630930              1.1906700              0.9874900        
L   1
  1      0.0848210              1.0000000              1.0000000        
D   3
  1     24.3214210              0.1577990        
  2      6.2238140              0.5114920        
  3      1.5887370              0.5857700


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: As
data:
ARSENIC
S   3
  1   5407.6138000              0.0626010        
  2    818.1743600              0.3727790        
  3    179.2656900              0.6851840        
L   3
  1    237.7783000             -0.1128380              0.1496800        
  2     54.2566200              0.0872270              0.5623220        
  3     16.3280300              0.9681880              0.4593230        
L   3
  1     17.1018500             -0.2914540              0.0256860        
  2      5.8051440              0.2969620              0.4833970        
  3      1.9020840              0.8865790              0.5887850        
L   2
  1      1.6754040             -0.5057610              0.0252820        
  2      0.3416560              1.2517640              0.9874330        
L   1
  1      0.1136300              1.0000000              1.0000000        
D   3
  1     27.4372090              0.1544950        
  2      7.0840440              0.5114320        
  3      1.8558230              0.5821940


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Se
data:
SELENIUM
S   3
  1   5751.3215000              0.0624930        
  2    870.2572100              0.3723680        
  3    190.7294900              0.6855800        
L   3
  1    255.0164000             -0.1119080              0.1461490        
  2     55.5765400              0.0909990              0.5813710        
  3     17.3566100              0.9636680              0.4374600        
L   3
  1     18.4456800             -0.2917930              0.0244210        
  2      6.3287590              0.2846210              0.4833650        
  3      2.0967580              0.8973050              0.5879040        
L   2
  1      1.8726330             -0.5677640              0.0282550        
  2      0.4174740              1.2941270              0.9849060        
L   1
  1      0.1370910              1.0000000              1.0000000        
D   3
  1     30.6274640              0.1519860        
  2      7.9712760              0.5116400        
  3      2.1348100              0.5786940


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Br
data:
BROMINE
S   3
  1   6103.2899000              0.0624180        
  2    923.6974300              0.3720410        
  3    202.5203100              0.6858730        
L   3
  1    270.6015000             -0.1121490              0.1477510        
  2     58.2535700              0.0931450              0.6010560        
  3     18.4693300              0.9616790              0.4128700        
L   3
  1     19.7614200             -0.2938700              0.0250070        
  2      6.8217520              0.2802660              0.4866100        
  3      2.2916290              0.9020360              0.5824230        
L   2
  1      2.1312060             -0.6518030              0.0287080        
  2      0.4993540              1.3360120              0.9840700        
L   1
  1      0.1647640              1.0000000              1.0000000        
D   3
  1     33.9650970              0.1496670        
  2      8.9008310              0.5117480        
  3      2.4284360              0.5759150


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Kr
data:
KRYPTON
S   3
  1   6446.6307000              0.0625400        
  2    976.8757000              0.3721070        
  3    214.4795500              0.6856110        
L   3
  1    287.6446000             -0.1120610              0.1475280        
  2     62.6200900              0.0901390              0.5868920        
  3     19.6917400              0.9643300              0.4295070        
L   3
  1     21.1232100             -0.2958170              0.0260700        
  2      7.3032860              0.2792170              0.4922500        
  3      2.4888500              0.9037300              0.5742740        
L   2
  1      2.3613740             -0.7202450              0.0287750        
  2      0.5860160              1.3768460              0.9833390        
L   1
  1      0.1944470              1.0000000              1.0000000        
D   3
  1     37.3681030              0.1479470        
  2      9.8543130              0.5121720        
  3      2.7327950              0.5729500


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Rb
data:
RUBIDIUM
S   3
  1   6816.7225000              0.0624960        
  2   1033.0007000              0.3719500        
  3    226.9086100              0.6857290        
L   3
  1    304.1283000             -0.1123300              0.1484410        
  2     66.2605800              0.0907510              0.5891250        
  3     20.9194500              0.9639410              0.4258250        
L   3
  1     22.4653300             -0.3004850              0.0244540        
  2      7.8774680              0.2783570              0.4944540        
  3      2.7052710              0.9076100              0.5718570        
L   3
  1      2.6921160             -0.3311620              0.0119010        
  2      0.7230560              0.5096990              0.4951730        
  3      0.2598380              0.6982460              0.5737240        
L   2
  1      0.1897140             -0.2711930              0.0003080        
  2      0.0339970              1.1415500              0.9998650        
L   1
  1      0.0147120              1.0000000              1.0000000        
D   3
  1     40.8660310              0.1466040        
  2     10.8408850              0.5127250        
  3      3.0508340              0.5699800


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Sr
data:
STRONTIUM
S   3
  1   7215.4735000              0.0622820        
  2   1092.8519000              0.3713100        
  3    239.9818200              0.6864440        
L   3
  1    322.1246000             -0.1122350              0.1488370        
  2     70.0904600              0.0895440              0.5919470        
  3     22.1764100              0.9648130              0.4221710        
L   3
  1     23.9276300             -0.3024720              0.0248370        
  2      8.4751140              0.2700840              0.4934780        
  3      2.9429340              0.9159200              0.5709830        
L   3
  1      2.9409660             -0.3519850              0.0097230        
  2      0.8523560              0.4972550              0.4983220        
  3      0.3215370              0.7238600              0.5650560        
L   2
  1      0.3480420             -0.2851470              0.0003080        
  2      0.0481770              1.1209390              0.9998930        
L   1
  1      0.0218030              1.0000000              1.0000000        
D   3
  1     44.5661150              0.1451270        
  2     11.8814890              0.5130680        
  3      3.3875580              0.5676640


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Y
data:
YTTRIUM
S   3
  1   7646.4210000              0.0618910        
  2   1156.8630000              0.3702070        
  3    253.7152000              0.6877560        
L   3
  1    341.8540000             -0.1119000              0.1485720        
  2     74.2098600              0.0868050              0.5943070        
  3     23.5135200              0.9667850              0.4196040        
L   3
  1     18.8626000             -1.4778730             -0.7041410        
  2     16.4540500              1.3472590              1.0578620        
  3      3.4845000              1.0062310              0.7393820        
L   3
  1      3.2217330             -0.3699580              0.0024940        
  2      1.0507050              0.4308640              0.4537620        
  3      0.3925920              0.8020870              0.6130680        
L   2
  1      0.4327640             -0.3464580             -0.0013370        
  2      0.0570120              1.1327770              1.0004400        
L   1
  1      0.0237540              1.0000000              1.0000000        
D   3
  1     50.3537500              0.1367960        
  2     13.5307800              0.5019060        
  3      3.9449960              0.5788600        
D   2
  1      1.5301370              0.3384030        
  2      0.6300670              0.7293290        
D   1
  1      0.2165880              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Zr
data:
ZIRCONIUM
S   3
  1   8084.5920000              0.0615780        
  2   1221.6680000              0.3693990        
  3    267.6917000              0.6887280        
L   3
  1    361.0212000             -0.1119070              0.1487620        
  2     78.3049500              0.0858400              0.5965690        
  3     24.8452300              0.9675130              0.4167850        
L   3
  1     20.0062800             -1.5443490             -0.7568480        
  2     17.5741500              1.4095960              1.1120900        
  3      3.7429850              1.0093490              0.7368020        
L   3
  1      3.5547880             -0.3793870              0.0025990        
  2      1.1789920              0.4232850              0.4599760        
  3      0.4446970              0.8140680              0.6058490        
L   2
  1      0.5050490             -0.3295120             -0.0012490        
  2      0.0621160              1.1207090              1.0003840        
L   1
  1      0.0255800              1.0000000              1.0000000        
D   3
  1     54.7232300              0.1348240        
  2     14.7741600              0.5005540        
  3      4.3589610              0.5787820        
D   2
  1      1.8628420              0.2850320        
  2      0.6433130              0.7972070        
D   1
  1      0.1993950              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Nb
data:
NIOBIUM
S   3
  1   8466.5170000              0.0618040        
  2   1281.2610000              0.3698050        
  3    281.2311000              0.6880790        
L   3
  1    379.4729000             -0.1121060              0.1496670        
  2     82.3358900              0.0865030              0.5987180        
  3     26.2224800              0.9670570              0.4132380        
L   3
  1     21.1629400             -1.5551310             -0.7554620        
  2     18.5897800              1.4179390              1.1139660        
  3      4.0099810              1.0106200              0.7327670        
L   3
  1      3.8363750             -0.3891040              0.0032900        
  2      1.3033250              0.4349700              0.4716450        
  3      0.4934310              0.8115900              0.5936990        
L   2
  1      0.5723730             -0.3156090             -0.0011330        
  2      0.0682030              1.1140470              1.0003380        
L   1
  1      0.0271570              1.0000000              1.0000000        
D   3
  1     59.0121900              0.1337100        
  2     16.0127900              0.5000390        
  3      4.7771850              0.5775380        
D   2
  1      1.9704430              0.3106810        
  2      0.6619350              0.7800690        
D   1
  1      0.2059970              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Mo
data:
MOLYBDENUM
S   3
  1   8899.4910000              0.0617060        
  2   1346.7640000              0.3694540        
  3    295.6352000              0.6884340        
L   3
  1    399.3139000             -0.1121440              0.1500660        
  2     86.5935600              0.0860110              0.6007690        
  3     27.6390400              0.9674330              0.4103860        
L   3
  1     22.5029200             -1.4223060             -0.6680660        
  2     19.4917100              1.2841850              1.0303460        
  3      4.2781800              1.0108660              0.7283480        
L   3
  1      4.1630210             -0.3964230              0.0029630        
  2      1.4353050              0.4370790              0.4791470        
  3      0.5437820              0.8148460              0.5864870        
L   2
  1      0.6318010             -0.3033620             -0.0010790        
  2      0.0732580              1.1084130              1.0003130        
L   1
  1      0.0280250              1.0000000              1.0000000        
D   3
  1     63.7804500              0.1317390        
  2     17.3735800              0.4985320        
  3      5.2307840              0.5781780        
D   2
  1      2.2709370              0.3112640        
  2      0.7546530              0.7810340        
D   1
  1      0.2351420              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Tc
data:
TECHNETIUM
S   3
  1   9329.4820000              0.0617120        
  2   1412.5060000              0.3693370        
  3    310.2643000              0.6884720        
L   3
  1    418.8175000             -0.1124030              0.1500720        
  2     91.2507800              0.0853180              0.6000570        
  3     29.1121200              0.9681770              0.4109860        
L   3
  1     25.9106400             -1.3804460             -1.6552710        
  2     23.2677000              1.1979000              1.9860200        
  3      4.7070830              1.0526490              0.7290340        
L   3
  1      4.4411380             -0.4041140              0.0122910        
  2      1.5956390              0.4398380              0.4632070        
  3      0.5955600              0.8219360              0.5983830        
L   2
  1      0.6738810             -0.2700030             -0.0009200        
  2      0.0772410              1.0991500              1.0002640        
L   1
  1      0.0286960              1.0000000              1.0000000        
D   3
  1     68.7837500              0.1296930        
  2     18.8038900              0.4966190        
  3      5.7052280              0.5795470        
D   2
  1      2.5991640              0.3092190        
  2      0.8622760              0.7829060        
D   1
  1      0.2706070              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ru
data:
RUTHENIUM
S   3
  1   9786.1610000              0.0616050        
  2   1481.4770000              0.3689820        
  3    325.4122000              0.6888450        
L   3
  1    439.8665000             -0.1123910              0.1503790        
  2     95.7627300              0.0846940              0.6019290        
  3     30.6056600              0.9686380              0.4084640        
L   3
  1     27.2773700             -1.3955530             -1.6686180        
  2     24.5108200              1.2108520              2.0027900        
  3      5.0089460              1.0540450              0.7251440        
L   3
  1      4.7658120             -0.4103630              0.0112740        
  2      1.7345310              0.4480030              0.4727030        
  3      0.6466360              0.8198080              0.5898430        
L   2
  1      0.7406620             -0.2639660             -0.0007620        
  2      0.0821710              1.0948570              1.0002120        
L   1
  1      0.0300970              1.0000000              1.0000000        
D   3
  1     73.9833000              0.1277600        
  2     20.2814900              0.4951470        
  3      6.1942980              0.5806550        
D   2
  1      2.8891080              0.3159940        
  2      0.9539610              0.7780660        
D   1
  1      0.2958810              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Rh
data:
RHODIUM
S   3
  1  10217.7100000              0.0617320        
  2   1548.4120000              0.3691530        
  3    340.4990000              0.6885140        
L   3
  1    460.7593000             -0.1124460              0.1508580        
  2    100.3289000              0.0843810              0.6035140        
  3     32.1397100              0.9689020              0.4060250        
L   3
  1     28.7932900             -1.4040910             -1.7122180        
  2     25.9176800              1.2161690              2.0476030        
  3      5.3206400              1.0565550              0.7229830        
L   3
  1      5.1097480             -0.4126470              0.0093740        
  2      1.8754140              0.4518850              0.4815540        
  3      0.6995580              0.8188990              0.5822310        
L   2
  1      0.8005710             -0.2553480             -0.0007760        
  2      0.0873210              1.0913080              1.0002120        
L   1
  1      0.0314070              1.0000000              1.0000000        
D   3
  1     79.2559700              0.1261900        
  2     21.7894500              0.4939540        
  3      6.6975180              0.5813300        
D   2
  1      3.1909080              0.3210400        
  2      1.0545750              0.7738520        
D   1
  1      0.3260790              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Pd
data:
PALLADIUM
S   3
  1  10728.7400000              0.0614290        
  2   1624.0740000              0.3683280        
  3    356.7937000              0.6895030        
L   3
  1    482.4783000             -0.1126790              0.1510790        
  2    105.0590000              0.0846120              0.6050920        
  3     33.6814500              0.9687870              0.4039800        
L   3
  1     30.1865400             -1.4185470             -1.7098170        
  2     27.1664200              1.2294440              2.0493080        
  3      5.6359340              1.0570830              0.7186300        
L   3
  1      5.4753740             -0.4172610              0.0115840        
  2      1.9976040              0.4705880              0.4974550        
  3      0.7439300              0.8046360              0.5655270        
L   2
  1      0.8901630             -0.2784320             -0.0012720        
  2      0.0928210              1.0930280              1.0003320        
L   1
  1      0.0337740              1.0000000              1.0000000        
D   3
  1     84.2369100              0.1256430        
  2     23.2491900              0.4937200        
  3      7.1967600              0.5803430        
D   2
  1      3.4730770              0.3281540        
  2      1.1480500              0.7680270        
D   1
  1      0.3548110              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ag
data:
SILVER
S   3
  1  11190.7800000              0.0614950        
  2   1695.0770000              0.3684050        
  3    372.6752000              0.6893250        
L   3
  1    504.6162000             -0.1126580              0.1514800        
  2    109.8718000              0.0840280              0.6065140        
  3     35.2951300              0.9692340              0.4018300        
L   3
  1     31.5687700             -1.4220280             -1.6733660        
  2     28.3439700              1.2340980              2.0189760        
  3      5.9451270              1.0556830              0.7126890        
L   3
  1      5.8002560             -0.4196170              0.0143040        
  2      2.1272560              0.4843500              0.5071940        
  3      0.7935510              0.7952030              0.5539740        
L   2
  1      0.9285440             -0.2523000             -0.0014810        
  2      0.0972550              1.0873920              1.0003880        
L   1
  1      0.0349330              1.0000000              1.0000000        
D   3
  1     89.9333500              0.1240160        
  2     24.8749600              0.4923830        
  3      7.7381910              0.5814970        
D   2
  1      3.7965570              0.3314260        
  2      1.2566440              0.7651630        
D   1
  1      0.3881330              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cd
data:
CADMIUM
S   3
  1  11686.0900000              0.0614270        
  2   1770.1110000              0.3681570        
  3    389.2090000              0.6895720        
L   3
  1    527.6004000             -0.1125920              0.1518050        
  2    114.8329000              0.0832700              0.6077600        
  3     36.9582900              0.9697980              0.3999630        
L   3
  1     33.0154800             -1.4064710             -1.6090240        
  2     29.5454300              1.2181560              1.9595680        
  3      6.2785080              1.0555200              0.7080270        
L   3
  1      6.1505960             -0.4229210              0.0144820        
  2      2.2597460              0.4987710              0.5186610        
  3      0.8414260              0.7850760              0.5426660        
L   2
  1      0.9490690             -0.2215550             -0.0015400        
  2      0.1014880              1.0809440              1.0004120        
L   1
  1      0.0359870              1.0000000              1.0000000        
D   3
  1     95.4727400              0.1230830        
  2     26.4819600              0.4916770        
  3      8.2828860              0.5815410        
D   2
  1      4.0821410              0.3379410        
  2      1.3572790              0.7591680        
D   1
  1      0.4208310              1.0000000


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: In
data:
INDIUM
S   3
  1  12214.5470000              0.0612480        
  2   1848.9136000              0.3676750        
  3    406.3683300              0.6901360        
L   3
  1    550.4423000             -0.1127090              0.1523700        
  2    119.7744000              0.0834440              0.6096510        
  3     38.6692700              0.9696880              0.3970250        
L   3
  1     47.0293100             -0.2758950             -0.1408480        
  2     22.4964200              0.0597730              0.5290870        
  3      6.6971170              1.0821480              0.6620680        
L   3
  1      6.5723600             -0.4284830              0.0109130        
  2      2.5021580              0.4633640              0.5036760        
  3      0.9420250              0.8219680              0.5581810        
L   2
  1      1.0012210             -0.4364170              0.0231630        
  2      0.1659700              1.1898930              0.9903310        
L   1
  1      0.0543400              1.0000000              1.0000000        
D   3
  1    102.1735600              0.1205560        
  2     28.3946320              0.4884980        
  3      8.9248050              0.5850190        
D   3
  1      4.5353640              0.2508570        
  2      1.5371480              0.5693110        
  3      0.4994920              0.3840640


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Sn
data:
TIN
S   3
  1  12741.6740000              0.0611350        
  2   1928.4692000              0.3672930        
  3    423.8079700              0.6905450        
L   3
  1    574.2875000             -0.1127460              0.1525800        
  2    124.9537000              0.0828630              0.6110110        
  3     40.3957600              0.9701510              0.3951550        
L   3
  1     48.8066200             -0.2824530             -0.1509630        
  2     23.8358800              0.0660560              0.5399680        
  3      7.0482960              1.0819870              0.6604820        
L   3
  1      6.9733780             -0.4340360              0.0119510        
  2      2.6930400              0.4610290              0.5067190        
  3      1.0259580              0.8285580              0.5529110        
L   2
  1      1.1314630             -0.5252080              0.0210710        
  2      0.2034090              1.2292260              0.9905910        
L   1
  1      0.0705640              1.0000000              1.0000000        
D   3
  1    108.0563000              0.1198240        
  2     30.1315760              0.4875910        
  3      9.5300360              0.5849870        
D   3
  1      4.9626100              0.2529490        
  2      1.7120830              0.5727610        
  3      0.5771950              0.3690390


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Sb
data:
ANTIMONY
S   3
  1  13289.3830000              0.0609840        
  2   2010.5218000              0.3668490        
  3    441.6981500              0.6910500        
L   3
  1    598.8890000             -0.1127200              0.1530670        
  2    130.0385000              0.0826440              0.6135970        
  3     42.1328600              0.9702580              0.3916990        
L   3
  1     51.5133300             -0.2770430             -0.1378700        
  2     24.4359500              0.0575030              0.5363550        
  3      7.4209310              1.0847030              0.6508680        
L   3
  1      7.3142350             -0.4403810              0.0153050        
  2      2.8440530              0.4737340              0.5160830        
  3      1.1058550              0.8221350              0.5387570        
L   2
  1      1.2786370             -0.6016950              0.0222530        
  2      0.2412320              1.2586920              0.9896430        
L   1
  1      0.0866300              1.0000000              1.0000000        
D   3
  1    115.8095500              0.1166280        
  2     32.3058350              0.4834360        
  3     10.2503280              0.5901400        
D   3
  1      5.4862100              0.2483660        
  2      1.9216200              0.5743150        
  3      0.6660630              0.3643040


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Te
data:
TELLURIUM
S   3
  1  13796.5600000              0.0610860        
  2   2088.8798000              0.3669630        
  3    459.3931900              0.6907940        
L   3
  1    623.2631000             -0.1128200              0.1534190        
  2    135.3600000              0.0822520              0.6149000        
  3     44.0004800              0.9706010              0.3895160        
L   3
  1     54.1907800             -0.2744120             -0.1433310        
  2     25.8203900              0.0518300              0.5391880        
  3      7.8095830              1.0876220              0.6522850        
L   3
  1      7.7642170             -0.4467310              0.0127460        
  2      3.0439320              0.4694700              0.5221230        
  3      1.1992530              0.8298110              0.5326610        
L   2
  1      1.3403640             -0.5904700              0.0255880        
  2      0.2780880              1.2819680              0.9871020        
L   1
  1      0.0967260              1.0000000              1.0000000        
D   3
  1    121.4083000              0.1169140        
  2     34.0152170              0.4835560        
  3     10.8691380              0.5883860        
D   3
  1      5.8031110              0.2601940        
  2      2.0580660              0.5797760        
  3      0.7328300              0.3405580


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: I
data:
IODINE
S   3
  1  14351.1860000              0.0610030        
  2   2173.0741000              0.3666400        
  3    477.8720500              0.6911310        
L   3
  1    648.1887000             -0.1128510              0.1541140        
  2    140.3064000              0.0832280              0.6194620        
  3     45.6988000              0.9697520              0.3837580        
L   3
  1     56.6946900             -0.2736970             -0.1523220        
  2     27.4887500              0.0465000              0.5437690        
  3      8.2090960              1.0915760              0.6561680        
L   3
  1      8.1916790             -0.4508280              0.0118700        
  2      3.2445960              0.4632090              0.5265250        
  3      1.3004890              0.8386360              0.5266080        
L   2
  1      1.4513800             -0.6658520              0.0275410        
  2      0.3281030              1.3285840              0.9851370        
L   1
  1      0.1150760              1.0000000              1.0000000        
D   3
  1    128.0902600              0.1158640        
  2     35.9823780              0.4820490        
  3     11.5511160              0.5894450        
D   3
  1      6.1461520              0.2681820        
  2      2.2209370              0.5800610        
  3      0.8099120              0.3262260


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Xe
data:
XENON
S   3
  1  14902.2360000              0.0609970        
  2   2256.5383000              0.3666290        
  3    496.3731700              0.6911150        
L   3
  1    673.6611000             -0.1129130              0.1544270        
  2    145.8491000              0.0829050              0.6206170        
  3     47.5770800              0.9700290              0.3820040        
L   3
  1     59.1675200             -0.2739770             -0.1518570        
  2     28.6115900              0.0455300              0.5471510        
  3      8.5965960              1.0925280              0.6519540        
L   3
  1      8.6386760             -0.4558410              0.0095850        
  2      3.4628180              0.4617360              0.5298190        
  3      1.4010400              0.8442880              0.5235980        
L   2
  1      1.5784740             -0.7277720              0.0280720        
  2      0.3750810              1.3627970              0.9842640        
L   1
  1      0.1331790              1.0000000              1.0000000        
D   3
  1    134.9133100              0.1150110        
  2     37.9563870              0.4815950        
  3     12.2274750              0.5896130        
D   3
  1      6.6004930              0.2718840        
  2      2.3980510              0.5855570        
  3      0.8864820              0.3127460


name: 3-21G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cs
data:
CESIUM
S   3
  1  15525.8660000              0.0607240        
  2   2349.0055000              0.3658420        
  3    516.2355500              0.6920470        
S   3
  1    687.5050500             -0.1102130        
  2     67.1911570              0.7272030        
  3     27.9920030              0.3401430        
S   3
  1     60.1681880             -0.2753150        
  2     10.8686940              0.8901280        
  3      4.7407050              0.2648630        
S   3
  1      9.8871630             -0.3688270        
  2      2.3693430              0.8325820        
  3      1.1416760              0.3887890        
S   3
  1      1.7690780             -0.3409420        
  2      0.3836200              0.7000970        
  3      0.1713060              0.4934520        
S   2
  1      0.2118490             -0.2750220        
  2      0.0403240              0.1936040        
S   1
  1      0.0170580              1.0000000        
P   3
  1   1024.2833000              0.0791850        
  2    239.6488900              0.4199330        
  3     71.2555480              0.6432510        
P   3
  1    139.4586400             -0.0331230        
  2     25.8108100              0.3891080        
  3     10.1394520              0.6790330        
P   3
  1      4.3242440              0.3816690        
  2      1.9364150              0.5769760        
  3      0.8145050              0.1154050        
P   1
  1      0.5945840              1.0000000        
P   1
  1      0.2749920              1.0000000        
P   1
  1      0.1115530              1.0000000        
D   3
  1    144.0513900              0.1118300        
  2     40.5051460              0.4768350        
  3     13.0862440              0.5954170        
D   3
  1      7.3715780              0.2537250        
  2      2.7248240              0.5788860        
  3      1.0266780              0.3325980


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: H
data:
HYDROGEN
S   3
  1    161.83169173             0.0253937        
  2     25.18637393             0.1834528        
  3      6.07863626             0.8542918        
S   1
  1      1.80702847             1.0000000        
S   1
  1      0.61073561             1.0000000        
S   1
  1      0.22624588             1.0000000        
S   1
  1      0.08936742             1.0000000        
P   1
  1      4.0475100              1.0000000        
P   1
  1      1.3959670              1.0000000        
P   1
  1      0.5815530              1.0000000        
P   1
  1      0.2306500              1.0000000        
D   1
  1      3.1458880              1.0000000        
D   1
  1      1.2529740              1.0000000        
D   1
  1      0.4964500              1.0000000        
F   1
  1      2.35689099             1.0000000        
F   1
  1      0.846080495            1.0000000        
G   1
  1      1.95092199             1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: He
data:
HELIUM
S   3
  1    502.89795760             0.0241033        
  2     76.98966010             0.1788896        
  3     17.98108986             0.8602233        
S   1
  1      5.1666475              1.0000000        
S   1
  1      1.65375887             1.0000000        
S   1
  1      0.55222753             1.0000000        
S   1
  1      0.18687559             1.0000000        
P   1
  1      9.4309800              1.0000000        
P   1
  1      3.0842310              1.0000000        
P   1
  1      1.1928690              1.0000000        
P   1
  1      0.4333830              1.0000000        
D   1
  1      7.2485900              1.0000000        
D   1
  1      2.4514720              1.0000000        
D   1
  1      0.8386060              1.0000000        
F   1
  1      4.95548999             1.0000000        
F   1
  1      1.522464995            1.0000000        
G   1
  1      3.01831999             1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Li
data:
LITHIUM
S   7
  1  17127.93537420             0.0001547        
  2   2497.40661844             0.0012481        
  3    562.27259889             0.0065066        
  4    163.08393246             0.0257400        
  5     54.89648725             0.0886074        
  6     19.82251340             0.2744049        
  7      7.55500940             0.6861592        
S   2
  1      3.09034298             0.5677981        
  2      1.51172322             0.4550967        
S   1
  1      0.96210085             1.0000000        
S   1
  1      0.46783812             1.0000000        
S   1
  1      0.14148455             1.0000000        
S   1
  1      0.06290531             1.0000000        
S   1
  1      0.02556651             1.0000000        
P   4
  1     14.08316342             0.0149026        
  2      3.48253334             0.0857440        
  3      1.16875608             0.2770039        
  4      0.44171959             0.7304660        
P   1
  1      0.19153207             1.0000000        
P   1
  1      0.08304937             1.0000000        
P   1
  1      0.03601067             1.0000000        
P   1
  1      0.01561443             1.0000000        
D   1
  1      0.54046144             1.0000000        
D   1
  1      0.03176130             1.0000000        
D   1
  1      0.01740388             1.0000000        
F   1
  1      0.40395157             1.0000000        
F   1
  1      0.13405969             1.0000000        
F   1
  1      0.06358208             1.0000000        
G   1
  1      0.27708273             1.0000000        
G   1
  1      0.10173004             1.0000000        
H   1
  1      0.19866925             1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Be
data:
BERYLLIUM
S   7
  1  35113.73237001             0.0002905        
  2   5622.06794074             0.0019874        
  3   1451.89229862             0.0084377        
  4    478.31538433             0.0288678        
  5    179.58762170             0.0867081        
  6     73.14995537             0.2443172        
  7     29.80270843             0.7047960        
S   2
  1     11.84393382             0.3632788        
  2      4.75518354             0.6702883        
S   1
  1      1.99296272             1.0000000        
S   1
  1      0.86139429             1.0000000        
S   1
  1      0.27338461             1.0000000        
S   1
  1      0.1213869              1.0000000        
S   1
  1      0.05068552             1.0000000        
P   4
  1     41.27811587             0.0082913        
  2      9.85632270             0.0605445        
  3      3.15257312             0.2447378        
  4      1.13484407             0.7796139        
P   1
  1      0.44384162             1.0000000        
P   1
  1      0.1853494              1.0000000        
P   1
  1      0.07987667             1.0000000        
P   1
  1      0.03426598             1.0000000        
D   1
  1      0.7440400              1.0000000        
D   1
  1      0.2439520              1.0000000        
D   1
  1      0.1035500              1.0000000        
D   1
  1      0.0479410              1.0000000        
F   1
  1      0.6925400              1.0000000        
F   1
  1      0.2629800              1.0000000        
F   1
  1      0.1082600              1.0000000        
G   1
  1      0.6025300              1.0000000        
G   1
  1      0.2182350              1.0000000        
H   1
  1      0.4356300              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: B
data:
BORON
S   7
  1  44619.05176262             0.0002914        
  2   7125.36513863             0.0020149        
  3   1803.68084943             0.0089058        
  4    580.54067302             0.0309781        
  5    218.63404386             0.0897983        
  6     90.26440232             0.2481101        
  7     37.00096560             0.6967123        
S   2
  1     14.87611660             0.3884779        
  2      6.08536865             0.6447955        
S   1
  1      2.62250304             1.0000000        
S   1
  1      1.16409076             1.0000000        
S   1
  1      0.41377316             1.0000000        
S   1
  1      0.17432441             1.0000000        
S   1
  1      0.07100882             1.0000000        
P   4
  1     62.90112139             0.0075673        
  2     15.00757832             0.0561691        
  3      4.77180021             0.2399848        
  4      1.72167995             0.7858024        
P   1
  1      0.68744868             1.0000000        
P   1
  1      0.30135719             1.0000000        
P   1
  1      0.1306912              1.0000000        
P   1
  1      0.05297458             1.0000000        
D   1
  1      1.26362333             1.0000000        
D   1
  1      0.66793666             1.0000000        
D   1
  1      0.32735833             1.0000000        
D   1
  1      0.129913165            1.0000000        
F   1
  1      1.2034800              1.0000000        
F   1
  1      0.6460610              1.0000000        
F   1
  1      0.2711605              1.0000000        
G   1
  1      1.0506710              1.0000000        
G   1
  1      0.4471355              1.0000000        
H   1
  1      0.7852510              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: C
data:
CARBON
S   7
  1  99843.71445783             0.0002042        
  2  15525.73168036             0.0014799        
  3   3752.53855341             0.0071086        
  4   1129.78811447             0.0274504        
  5    398.78120693             0.0858865        
  6    158.70655076             0.2428513        
  7     63.80819609             0.7102296        
S   2
  1     25.11653126             0.3708772        
  2     10.06978388             0.6631117        
S   1
  1      4.27260269             1.0000000        
S   1
  1      1.88087317             1.0000000        
S   1
  1      0.65168676             1.0000000        
S   1
  1      0.26742884             1.0000000        
S   1
  1      0.10478261             1.0000000        
P   3
  1    138.77776536             0.0202006        
  2     32.24111126             0.1714572        
  3      9.86718977             0.8732019        
P   2
  1      3.39670221             0.2887295        
  2      1.27751119             0.7650397        
P   1
  1      0.54017269             1.0000000        
P   1
  1      0.23362742             1.0000000        
P   1
  1      0.08918995             1.0000000        
D   1
  1      2.24968466             1.0000000        
D   1
  1      0.99486743             1.0000000        
D   1
  1      0.47715076             1.0000000        
D   1
  1      0.19192538             1.0000000        
F   1
  1      1.9921100              1.0000000        
F   1
  1      0.9836410              1.0000000        
F   1
  1      0.4036255              1.0000000        
G   1
  1      1.6416600              1.0000000        
G   1
  1      0.6730450              1.0000000        
H   1
  1      1.2192040              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: N
data:
NITROGEN
S   7
  1 110875.80119773             0.0002114        
  2  16977.18007784             0.0015784        
  3   4009.01332708             0.0078066        
  4   1196.71297512             0.0299096        
  5    425.73556650             0.0915728        
  6    171.09715795             0.2521997        
  7     70.23825224             0.6936713        
S   2
  1     28.50295390             0.3929267        
  2     11.76144286             0.6398963        
S   1
  1      5.16118881             1.0000000        
S   1
  1      2.45028139             1.0000000        
S   1
  1      0.84876697             1.0000000        
S   1
  1      0.35071346             1.0000000        
S   1
  1      0.13727583             1.0000000        
P   4
  1    138.41479298             0.0070338        
  2     33.38853280             0.0532736        
  3     10.77157634             0.2391197        
  4      3.94856076             0.7861570        
P   1
  1      1.57723713             1.0000000        
P   1
  1      0.66008314             1.0000000        
P   1
  1      0.27379176             1.0000000        
P   1
  1      0.10722001             1.0000000        
D   1
  1      3.3085400              1.0000000        
D   1
  1      1.4325455              1.0000000        
D   1
  1      0.6865240              1.0000000        
D   1
  1      0.2730390              1.0000000        
F   1
  1      2.8984060              1.0000000        
F   1
  1      1.3508890              1.0000000        
F   1
  1      0.5496045              1.0000000        
G   1
  1      2.3973200              1.0000000        
G   1
  1      0.9572850              1.0000000        
H   1
  1      1.7448430              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: O
data:
OXYGEN
S   7
  1 156894.60157870             0.0001913        
  2  24442.81532316             0.0013963        
  3   5802.69011377             0.0069384        
  4   1708.15734565             0.0275656        
  5    588.75243511             0.0893888        
  6    228.76864439             0.2544313        
  7     92.62254497             0.6968868        
S   2
  1     37.54229793             0.3925652        
  2     15.49895784             0.6402121        
S   1
  1      6.84292374             1.0000000        
S   1
  1      3.34692004             1.0000000        
S   1
  1      1.14119722             1.0000000        
S   1
  1      0.47322973             1.0000000        
S   1
  1      0.18586957             1.0000000        
P   4
  1    180.02397718             0.0066821        
  2     43.06011728             0.0520076        
  3     13.71477176             0.2411364        
  4      4.99384624             0.7859072        
P   1
  1      2.0015185              1.0000000        
P   1
  1      0.83186163             1.0000000        
P   1
  1      0.33431268             1.0000000        
P   1
  1      0.12503207             1.0000000        
D   1
  1      5.06577134             1.0000000        
D   1
  1      2.09284665             1.0000000        
D   1
  1      0.94065533             1.0000000        
D   1
  1      0.357049665            1.0000000        
F   1
  1      4.0255100              1.0000000        
F   1
  1      1.72258698             1.0000000        
F   1
  1      0.66065149             1.0000000        
G   1
  1      3.15809208             1.0000000        
G   1
  1      1.18578004             1.0000000        
H   1
  1      2.30598008             1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: F
data:
FLUORINE
S   7
  1 201780.46087009             0.0001869        
  2  30898.31903683             0.0014011        
  3   7234.65566592             0.0070426        
  4   2133.14721413             0.0275348        
  5    744.39428028             0.0877227        
  6    290.13277191             0.2529832        
  7    116.64858272             0.6998403        
S   2
  1     47.19151943             0.3950501        
  2     19.55314173             0.6375586        
S   1
  1      8.70784239             1.0000000        
S   1
  1      4.36530031             1.0000000        
S   1
  1      1.47184834             1.0000000        
S   1
  1      0.60999841             1.0000000        
S   1
  1      0.23913194             1.0000000        
P   4
  1    231.17975755             0.0064174        
  2     54.65276977             0.0514188        
  3     17.26226805             0.2430376        
  4      6.27269779             0.7849049        
P   1
  1      2.51607765             1.0000000        
P   1
  1      1.04352047             1.0000000        
P   1
  1      0.4164553              1.0000000        
P   1
  1      0.15408348             1.0000000        
D   1
  1      7.02867366             1.0000000        
D   1
  1      2.83350933             1.0000000        
D   1
  1      1.24473986             1.0000000        
D   1
  1      0.46292793             1.0000000        
F   1
  1      5.2563300              1.0000000        
F   1
  1      2.1856510              1.0000000        
F   1
  1      0.8318480              1.0000000        
G   1
  1      4.2445100              1.0000000        
G   1
  1      1.5368120              1.0000000        
H   1
  1      2.9700500              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Ne
data:
NEON
S   7
  1 296875.44742524             0.0001572        
  2  44216.60957102             0.0012337        
  3  10028.59034580             0.0064627        
  4   2886.29466253             0.0259718        
  5    989.11081384             0.0847337        
  6    377.98558880             0.2521428        
  7    149.63777863             0.7056272        
S   2
  1     60.18439037             0.3933721        
  2     24.93539479             0.6391849        
S   1
  1     11.1400476              1.0000000        
S   1
  1      5.50369978             1.0000000        
S   1
  1      1.86525737             1.0000000        
S   1
  1      0.76856319             1.0000000        
S   1
  1      0.2988420              1.0000000        
P   4
  1    318.41910773             0.0059016        
  2     75.09956976             0.0483701        
  3     23.65165298             0.2366923        
  4      8.54309293             0.7924927        
P   1
  1      3.38222767             1.0000000        
P   1
  1      1.37489687             1.0000000        
P   1
  1      0.53738186             1.0000000        
P   1
  1      0.19398875             1.0000000        
D   1
  1      9.0292000              1.0000000        
D   1
  1      3.5896709              1.0000000        
D   1
  1      1.5631400              1.0000000        
D   1
  1      0.5759500              1.0000000        
F   1
  1      6.8642400              1.0000000        
F   1
  1      2.8212100              1.0000000        
F   1
  1      1.0744450              1.0000000        
G   1
  1      5.3643000              1.0000000        
G   1
  1      1.9073500              1.0000000        
H   1
  1      3.7565000              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Na
data:
SODIUM
S   8
  1 549632.88956726             0.0000780        
  2  84078.05692532             0.0005848        
  3  19869.80603660             0.0028698        
  4   6034.60080773             0.0106142        
  5   2219.80237461             0.0310228        
  6    919.65318407             0.0860512        
  7    381.11593242             0.2545434        
  8    154.92917204             0.6919621        
S   2
  1     64.02898735             0.4139641        
  2     27.49546072             0.6167258        
S   1
  1     12.24878260             1.0000000        
S   1
  1      5.30211534             1.0000000        
S   1
  1      2.54525720             1.0000000        
S   1
  1      1.22127178             1.0000000        
S   1
  1      0.66669525             1.0000000        
S   1
  1      0.36430490             1.0000000        
S   1
  1      0.06226253             1.0000000        
S   1
  1      0.02441244             1.0000000        
P   6
  1    374.93024675             0.0013745        
  2    101.97625581             0.0092096        
  3     34.83908888             0.0411864        
  4     13.18052024             0.1484646        
  5      5.02859188             0.3784253        
  6      1.93351579             0.5723821        
P   1
  1      0.74344536             1.0000000        
P   1
  1      0.28585803             1.0000000        
P   1
  1      0.10991367             1.0000000        
P   1
  1      0.04226229             1.0000000        
P   1
  1      0.01625004             1.0000000        
P   1
  1      0.00624821             1.0000000        
D   1
  1      0.17539870             1.0000000        
D   1
  1      0.09610944             1.0000000        
D   1
  1      0.06080667             1.0000000        
D   1
  1      0.02350536             1.0000000        
F   1
  1      0.17754129             1.0000000        
F   1
  1      0.15190465             1.0000000        
F   1
  1      0.06149322             1.0000000        
G   1
  1      0.17882158             1.0000000        
G   1
  1      0.09136502             1.0000000        
H   1
  1      0.14644453             1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Mg
data:
MAGNESIUM
S   8
  1 664680.24662198             0.0000778        
  2 101432.92555770             0.0005844        
  3  23962.99827352             0.0028704        
  4   7249.00086620             0.0107432        
  5   2624.09973010             0.0325514        
  6   1070.26812425             0.0900468        
  7    449.08814798             0.2555585        
  8    186.14536596             0.6853588        
S   2
  1     77.55001432             0.4074557        
  2     33.08731143             0.6235054        
S   1
  1     15.54003399             1.0000000        
S   1
  1      9.07232004             1.0000000        
S   1
  1      2.74160384             1.0000000        
S   1
  1      1.19347261             1.0000000        
S   1
  1      0.54844488             1.0000000        
S   1
  1      0.1658108              1.0000000        
S   1
  1      0.0788094              1.0000000        
S   1
  1      0.03519519             1.0000000        
P   6
  1    760.28507184             0.0007503        
  2    177.04167496             0.0066346        
  3     55.09346986             0.0364607        
  4     19.66759322             0.1403908        
  5      7.68679148             0.3624653        
  6      3.15554537             0.5874114        
P   1
  1      1.33140257             1.0000000        
P   1
  1      0.57084614             1.0000000        
P   1
  1      0.19432891             1.0000000        
P   1
  1      0.08268454             1.0000000        
P   1
  1      0.03691338             1.0000000        
P   1
  1      0.01704311             1.0000000        
D   1
  1      0.5269100              1.0000000        
D   1
  1      0.1972670              1.0000000        
D   1
  1      0.0887000              1.0000000        
D   1
  1      0.0397450              1.0000000        
F   1
  1      0.9758400              1.0000000        
F   1
  1      0.2531800              1.0000000        
F   1
  1      0.0991000              1.0000000        
G   1
  1      0.2761200              1.0000000        
G   1
  1      0.1109140              1.0000000        
H   1
  1      0.2337090              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Al
data:
ALUMINUM
S   8
  1 935084.31288260             0.0000796        
  2 143677.63413932             0.0005903        
  3  34216.07824186             0.0028786        
  4  10337.94724075             0.0108943        
  5   3718.63965245             0.0332230        
  6   1529.29549568             0.0891101        
  7    655.14416987             0.2495991        
  8    274.16961124             0.6899743        
S   2
  1    114.31556643             0.3809932        
  2     48.87006900             0.6490291        
S   1
  1     22.16547155             1.0000000        
S   1
  1     10.65996031             1.0000000        
S   1
  1      3.7581888              1.0000000        
S   1
  1      1.73170114             1.0000000        
S   1
  1      0.80392817             1.0000000        
S   1
  1      0.26251652             1.0000000        
S   1
  1      0.12016641             1.0000000        
S   1
  1      0.05121355             1.0000000        
P   6
  1   1719.05329755             0.0004257        
  2    409.85069914             0.0036764        
  3    131.97892543             0.0207724        
  4     48.23452641             0.0903041        
  5     18.93324079             0.2999894        
  6      7.85932367             0.6868896        
P   1
  1      3.37486181             1.0000000        
P   1
  1      1.48539679             1.0000000        
P   1
  1      0.65379476             1.0000000        
P   1
  1      0.24507035             1.0000000        
P   1
  1      0.09725269             1.0000000        
P   1
  1      0.03779873             1.0000000        
D   1
  1      0.46583666             1.0000000        
D   1
  1      0.35782033             1.0000000        
D   1
  1      0.17179833             1.0000000        
D   1
  1      0.06652533             1.0000000        
F   1
  1      0.5233130              1.0000000        
F   1
  1      0.3700930              1.0000000        
F   1
  1      0.1502100              1.0000000        
G   1
  1      0.5097610              1.0000000        
G   1
  1      0.2443410              1.0000000        
H   1
  1      0.4206410              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Si
data:
SILICON
S   8
  1 1060955.95691063            0.0000905        
  2 165708.53985054             0.0006406        
  3  41210.72818364             0.0029581        
  4  12685.90175359             0.0111555        
  5   4558.01390332             0.0345335        
  6   1874.38755704             0.0909458        
  7    816.19846826             0.2485906        
  8    346.32280368             0.6871018        
S   2
  1    145.25787168             0.3714467        
  2     62.27886054             0.6580534        
S   1
  1     28.18899929             1.0000000        
S   1
  1     13.25810927             1.0000000        
S   1
  1      4.73484974             1.0000000        
S   1
  1      2.22559522             1.0000000        
S   1
  1      1.04811179             1.0000000        
S   1
  1      0.36794795             1.0000000        
S   1
  1      0.16695352             1.0000000        
S   1
  1      0.07032384             1.0000000        
P   6
  1   1499.38112966             0.0006426        
  2    364.88698717             0.0052266        
  3    121.86861242             0.0266773        
  4     46.72832665             0.1037434        
  5     19.24183390             0.3121011        
  6      8.29104244             0.6574461        
P   1
  1      3.66638816             1.0000000        
P   1
  1      1.64839176             1.0000000        
P   1
  1      0.71589957             1.0000000        
P   1
  1      0.3091828              1.0000000        
P   1
  1      0.12792476             1.0000000        
P   1
  1      0.0512258              1.0000000        
D   1
  1      0.72794666             1.0000000        
D   1
  1      0.33042476             1.0000000        
D   1
  1      0.12462738             1.0000000        
F   1
  1      0.6713710              1.0000000        
F   1
  1      0.4516255              1.0000000        
F   1
  1      0.1902000              1.0000000        
G   1
  1      0.6828200              1.0000000        
G   1
  1      0.3269610              1.0000000        
H   1
  1      0.5690410              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: P
data:
PHOSPHORUS
S   8
  1 1179999.98661496            0.0001238        
  2 194943.06295668             0.0007596        
  3  55576.97387328             0.0029067        
  4  18389.73627886             0.0105922        
  5   6813.84397000             0.0322061        
  6   2831.55905178             0.0857174        
  7   1224.04259121             0.2428795        
  8    511.10472991             0.6994200        
S   2
  1    210.94626554             0.3484496        
  2     89.06075411             0.6811469        
S   1
  1     39.47568423             1.0000000        
S   1
  1     17.8357713              1.0000000        
S   1
  1      6.19322063             1.0000000        
S   1
  1      2.96546309             1.0000000        
S   1
  1      1.39347273             1.0000000        
S   1
  1      0.49388545             1.0000000        
S   1
  1      0.22470427             1.0000000        
S   1
  1      0.09275952             1.0000000        
P   6
  1   1763.67411283             0.0006399        
  2    427.04763107             0.0052714        
  3    142.07960138             0.0270828        
  4     54.65772181             0.1045688        
  5     22.71678698             0.3114760        
  6      9.89513546             0.6556096        
P   1
  1      4.42191244             1.0000000        
P   1
  1      1.99791413             1.0000000        
P   1
  1      0.84967124             1.0000000        
P   1
  1      0.38936311             1.0000000        
P   1
  1      0.16663504             1.0000000        
P   1
  1      0.06770611             1.0000000        
D   1
  1      1.0390390              1.0000000        
D   1
  1      0.4211760              1.0000000        
D   1
  1      0.1608280              1.0000000        
F   1
  1      0.8506790              1.0000000        
F   1
  1      0.5592465              1.0000000        
F   1
  1      0.2426710              1.0000000        
G   1
  1      0.8900800              1.0000000        
G   1
  1      0.4233450              1.0000000        
H   1
  1      0.7404650              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: S
data:
SULFUR
S   8
  1 1212999.21922839            0.0001513        
  2 203576.92852534             0.0008848        
  3  61945.88868383             0.0030186        
  4  21506.73946780             0.0107200        
  5   8116.57308200             0.0324637        
  6   3386.04934479             0.0866057        
  7   1471.43313117             0.2427963        
  8    618.77938709             0.6977999        
S   2
  1    256.38261605             0.3423964        
  2    108.28988434             0.6869099        
S   1
  1     47.75992728             1.0000000        
S   1
  1     21.35368922             1.0000000        
S   1
  1      7.47459101             1.0000000        
S   1
  1      3.63373918             1.0000000        
S   1
  1      1.71216477             1.0000000        
S   1
  1      0.61956519             1.0000000        
S   1
  1      0.28214609             1.0000000        
S   1
  1      0.11682643             1.0000000        
P   6
  1   2271.28493538             0.0005655        
  2    552.81087316             0.0046292        
  3    184.73599046             0.0240344        
  4     70.86191924             0.0963185        
  5     29.16169132             0.3021561        
  6     12.57504775             0.6730739        
P   1
  1      5.57521883             1.0000000        
P   1
  1      2.49784707             1.0000000        
P   1
  1      1.04215054             1.0000000        
P   1
  1      0.47342848             1.0000000        
P   1
  1      0.19908054             1.0000000        
P   1
  1      0.0785522              1.0000000        
D   1
  1      1.23298065             1.0000000        
D   1
  1      0.78380133             1.0000000        
D   1
  1      0.416125665            1.0000000        
D   1
  1      0.15680034             1.0000000        
F   1
  1      1.08536698             1.0000000        
F   1
  1      0.65563349             1.0000000        
F   1
  1      0.2762400              1.0000000        
G   1
  1      1.06238508             1.0000000        
G   1
  1      0.47884254             1.0000000        
H   1
  1      0.87614254             1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Cl
data:
CHLORINE
S   8
  1 1239999.57729787            0.0001672        
  2 210420.39318093             0.0009404        
  3  67964.81345987             0.0028778        
  4  24415.66238126             0.0102864        
  5   9161.00128229             0.0324292        
  6   3715.04258744             0.0903201        
  7   1597.95594775             0.2466156        
  8    680.26304230             0.6911145        
S   2
  1    285.07031310             0.3434979        
  2    121.21790284             0.6854313        
S   1
  1     53.80009801             1.0000000        
S   1
  1     24.20502198             1.0000000        
S   1
  1      8.36684037             1.0000000        
S   1
  1      4.10142477             1.0000000        
S   1
  1      1.97113844             1.0000000        
S   1
  1      0.76887336             1.0000000        
S   1
  1      0.34689176             1.0000000        
S   1
  1      0.1433258              1.0000000        
P   6
  1   2618.33990591             0.0005425        
  2    635.04667449             0.0044872        
  3    210.85882567             0.0236809        
  4     80.32220507             0.0962632        
  5     32.90489855             0.3032841        
  6     14.15944766             0.6726512        
P   1
  1      6.28420241             1.0000000        
P   1
  1      2.82878129             1.0000000        
P   1
  1      1.16523475             1.0000000        
P   1
  1      0.53827439             1.0000000        
P   1
  1      0.23168693             1.0000000        
P   1
  1      0.09264925             1.0000000        
D   1
  1      2.23841833             1.0000000        
D   1
  1      1.11409786             1.0000000        
D   1
  1      0.55642893             1.0000000        
D   1
  1      0.21391866             1.0000000        
F   1
  1      1.3129300              1.0000000        
F   1
  1      0.7885550              1.0000000        
F   1
  1      0.3379800              1.0000000        
G   1
  1      1.3050700              1.0000000        
G   1
  1      0.5807910              1.0000000        
H   1
  1      1.0623500              1.0000000


name: 5ZP
description: All-electron 5 zeta plus polarization functions.
elt: Ar
data:
ARGON
S   8
  1 1251999.04959334            0.0001956        
  2 213336.65722743             0.0010797        
  3  72643.24239158             0.0029092        
  4  27483.75054174             0.0102117        
  5  10446.66484059             0.0325935        
  6   4209.43801470             0.0922861        
  7   1808.89062320             0.2483925        
  8    776.99019491             0.6871461        
S   2
  1    327.84598593             0.3408078        
  2    139.72156702             0.6878625        
S   1
  1     61.96763869             1.0000000        
S   1
  1     27.80493062             1.0000000        
S   1
  1      9.60192681             1.0000000        
S   1
  1      4.75963151             1.0000000        
S   1
  1      2.3059598              1.0000000        
S   1
  1      0.93089231             1.0000000        
S   1
  1      0.41830002             1.0000000        
S   1
  1      0.17210954             1.0000000        
P   6
  1   2664.10276522             0.0006133        
  2    646.42070990             0.0050447        
  3    215.74263427             0.0260394        
  4     83.08964945             0.1024178        
  5     34.51137758             0.3101591        
  6     15.04706101             0.6586914        
P   1
  1      6.79179336             1.0000000        
P   1
  1      3.1252798              1.0000000        
P   1
  1      1.30375704             1.0000000        
P   1
  1      0.60599797             1.0000000        
P   1
  1      0.26518486             1.0000000        
P   1
  1      0.10762478             1.0000000        
D   1
  1      3.4440409              1.0000000        
D   1
  1      1.4007430              1.0000000        
D   1
  1      0.6905200              1.0000000        
D   1
  1      0.2709110              1.0000000        
F   1
  1      1.5699800              1.0000000        
F   1
  1      0.9499550              1.0000000        
F   1
  1      0.4122600              1.0000000        
G   1
  1      1.5778400              1.0000000        
G   1
  1      0.6979800              1.0000000        
H   1
  1      1.2770940              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: H
data:
HYDROGEN
S   3
  1    161.83169173             0.0238856        
  2     25.18637393             0.1725577        
  3      6.07863626             0.8035566        
S   1
  1      1.80702847             1.0000000        
S   1
  1      0.61073561             1.0000000        
S   1
  1      0.22624588             1.0000000        
S   1
  1      0.08936742             1.0000000        
P   1
  1      4.0475100              1.0000000        
P   1
  1      1.3959670              1.0000000        
P   1
  1      0.5815530              1.0000000        
P   1
  1      0.2306500              1.0000000        
D   1
  1      3.1458880              1.0000000        
D   1
  1      1.2529740              1.0000000        
D   1
  1      0.4964500              1.0000000        
F   1
  1      2.35689099             1.0000000        
F   1
  1      0.846080495            1.0000000        
G   1
  1      1.95092199             1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: He
data:
HELIUM
S   3
  1    502.89795759             0.0230741        
  2     76.9896601              0.1681946        
  3     17.98108986             0.8087312        
S   1
  1      5.1666475              1.0000000        
S   1
  1      1.65375887             1.0000000        
S   1
  1      0.55222753             1.0000000        
S   1
  1      0.18687559             1.0000000        
P   1
  1      9.4309800              1.0000000        
P   1
  1      3.0842310              1.0000000        
P   1
  1      1.1928690              1.0000000        
P   1
  1      0.4333830              1.0000000        
D   1
  1      7.2485900              1.0000000        
D   1
  1      2.4514720              1.0000000        
D   1
  1      0.8386060              1.0000000        
F   1
  1      4.95548999             1.0000000        
F   1
  1      1.522464995            1.0000000        
G   1
  1      3.01831999             1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Li
data:
LITHIUM
S   7
  1  17127.9353742              0.0002089        
  2   2497.40661844             0.0012345        
  3    562.27259889             0.0061106        
  4    163.08393246             0.0238821        
  5     54.89648725             0.0819029        
  6     19.8225134              0.2533010        
  7      7.5550094              0.6333598        
S   2
  1      3.09034298             0.5540297        
  2      1.51172322             0.4459702        
S   1
  1      0.96210085             1.0000000        
S   1
  1      0.46783812             1.0000000        
S   1
  1      0.14148455             1.0000000        
S   1
  1      0.06290531             1.0000000        
S   1
  1      0.02556651             1.0000000        
P   4
  1     14.08316342             0.0134485        
  2      3.48253334             0.0773781        
  3      1.16875608             0.2499772        
  4      0.44171959             0.6591961        
P   1
  1      0.19153207             1.0000000        
P   1
  1      0.08304937             1.0000000        
P   1
  1      0.03601067             1.0000000        
P   1
  1      0.01561443             1.0000000        
D   1
  1      0.54046144             1.0000000        
D   1
  1      0.03176130             1.0000000        
D   1
  1      0.01740388             1.0000000        
F   1
  1      0.40395157             1.0000000        
F   1
  1      0.13405969             1.0000000        
F   1
  1      0.06358208             1.0000000        
G   1
  1      0.27708273             1.0000000        
G   1
  1      0.10173004             1.0000000        
H   1
  1      0.19866925             1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Be
data:
BERYLLIUM
S   7
  1  35113.73237001             0.0004858        
  2   5622.06794074             0.0021365        
  3   1451.89229862             0.0081783        
  4    478.31538433             0.0272201        
  5    179.5876217              0.0808310        
  6     73.14995537             0.2273291        
  7     29.80270843             0.6538190        
S   2
  1     11.84393382             0.3510328        
  2      4.75518354             0.6489671        
S   1
  1      1.99296272             1.0000000        
S   1
  1      0.86139429             1.0000000        
S   1
  1      0.27338461             1.0000000        
S   1
  1      0.1213869              1.0000000        
S   1
  1      0.05068552             1.0000000        
P   4
  1     41.27811587             0.0075844        
  2      9.8563227              0.0553834        
  3      3.15257312             0.2238754        
  4      1.13484407             0.7131567        
P   1
  1      0.44384162             1.0000000        
P   1
  1      0.1853494              1.0000000        
P   1
  1      0.07987667             1.0000000        
P   1
  1      0.03426598             1.0000000        
D   1
  1      0.7440400              1.0000000        
D   1
  1      0.2439520              1.0000000        
D   1
  1      0.1035500              1.0000000        
D   1
  1      0.0479410              1.0000000        
F   1
  1      0.6925400              1.0000000        
F   1
  1      0.2629800              1.0000000        
F   1
  1      0.1082600              1.0000000        
G   1
  1      0.6025300              1.0000000        
G   1
  1      0.2182350              1.0000000        
H   1
  1      0.4356300              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: B
data:
BORON
S   7
  1  44619.05176262             0.0005273        
  2   7125.36513862             0.0022401        
  3   1803.68084943             0.0087153        
  4    580.54067302             0.0292589        
  5    218.63404386             0.0836296        
  6     90.26440232             0.2307077        
  7     37.0009656              0.6449211        
S   2
  1     14.8761166              0.3762538        
  2      6.08536865             0.6237461        
S   1
  1      2.62250304             1.0000000        
S   1
  1      1.16409076             1.0000000        
S   1
  1      0.41377316             1.0000000        
S   1
  1      0.17432441             1.0000000        
S   1
  1      0.07100882             1.0000000        
P   4
  1     62.90112139             0.0069733        
  2     15.00757832             0.0516929        
  3      4.77180021             0.2187545        
  4      1.72167995             0.7225792        
P   1
  1      0.68744868             1.0000000        
P   1
  1      0.30135719             1.0000000        
P   1
  1      0.1306912              1.0000000        
P   1
  1      0.05297458             1.0000000        
D   1
  1      1.26362333             1.0000000        
D   1
  1      0.66793666             1.0000000        
D   1
  1      0.32735833             1.0000000        
D   1
  1      0.129913165            1.0000000        
F   1
  1      1.2034800              1.0000000        
F   1
  1      0.6460610              1.0000000        
F   1
  1      0.2711605              1.0000000        
G   1
  1      1.0506710              1.0000000        
G   1
  1      0.4471355              1.0000000        
H   1
  1      0.7852510              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: C
data:
CARBON
S   7
  1  99843.71445783             0.0004926        
  2  15525.73168036             0.0019153        
  3   3752.53855341             0.0073420        
  4   1129.78811447             0.0263740        
  5    398.78120693             0.0804213        
  6    158.70655076             0.2262231        
  7     63.80819609             0.6572313        
S   2
  1     25.11653126             0.3591301        
  2     10.06978388             0.6408698        
S   1
  1      4.27260269             1.0000000        
S   1
  1      1.88087317             1.0000000        
S   1
  1      0.65168676             1.0000000        
S   1
  1      0.26742884             1.0000000        
S   1
  1      0.10478261             1.0000000        
P   3
  1    138.77776536             0.0193143        
  2     32.24111126             0.1630782        
  3      9.86718977             0.8176074        
P   2
  1      3.39670221             0.2814624        
  2      1.27751119             0.7185375        
P   1
  1      0.54017269             1.0000000        
P   1
  1      0.23362742             1.0000000        
P   1
  1      0.08918995             1.0000000        
D   1
  1      2.24968466             1.0000000        
D   1
  1      0.99486743             1.0000000        
D   1
  1      0.47715076             1.0000000        
D   1
  1      0.19192538             1.0000000        
F   1
  1      1.9921100              1.0000000        
F   1
  1      0.9836410              1.0000000        
F   1
  1      0.4036255              1.0000000        
G   1
  1      1.6416600              1.0000000        
G   1
  1      0.6730450              1.0000000        
H   1
  1      1.2192040              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: N
data:
NITROGEN
S   7
  1 110875.80119773             0.0005319        
  2  16977.18007784             0.0020895        
  3   4009.01332708             0.0081145        
  4   1196.71297512             0.0287407        
  5    425.7355665              0.0856619        
  6    171.09715795             0.2343398        
  7     70.23825223             0.6405214        
S   2
  1     28.5029539              0.3812122        
  2     11.76144286             0.6187877        
S   1
  1      5.16118881             1.0000000        
S   1
  1      2.45028139             1.0000000        
S   1
  1      0.84876697             1.0000000        
S   1
  1      0.35071346             1.0000000        
S   1
  1      0.13727583             1.0000000        
P   4
  1    138.41479298             0.0066210        
  2     33.3885328              0.0493282        
  3     10.77157634             0.2206127        
  4      3.94856076             0.7234380        
P   1
  1      1.57723713             1.0000000        
P   1
  1      0.66008314             1.0000000        
P   1
  1      0.27379176             1.0000000        
P   1
  1      0.10722001             1.0000000        
D   1
  1      3.3085400              1.0000000        
D   1
  1      1.4325455              1.0000000        
D   1
  1      0.6865240              1.0000000        
D   1
  1      0.2730390              1.0000000        
F   1
  1      2.8984060              1.0000000        
F   1
  1      1.3508890              1.0000000        
F   1
  1      0.5496045              1.0000000        
G   1
  1      2.3973200              1.0000000        
G   1
  1      0.9572850              1.0000000        
H   1
  1      1.7448430              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: O
data:
OXYGEN
S   7
  1 156894.6015787              0.0005552        
  2  24442.81532316             0.0020318        
  3   5802.69011377             0.0075455        
  4   1708.15734565             0.0268836        
  5    588.75243511             0.0839548        
  6    228.76864439             0.2364401        
  7     92.62254497             0.6425887        
S   2
  1     37.54229793             0.3811633        
  2     15.49895784             0.6188366        
S   1
  1      6.84292374             1.0000000        
S   1
  1      3.34692004             1.0000000        
S   1
  1      1.14119722             1.0000000        
S   1
  1      0.47322973             1.0000000        
S   1
  1      0.18586957             1.0000000        
P   4
  1    180.02397718             0.0063534        
  2     43.06011728             0.0482756        
  3     13.71477176             0.2235563        
  4      4.99384624             0.7218146        
P   1
  1      2.0015185              1.0000000        
P   1
  1      0.83186163             1.0000000        
P   1
  1      0.33431268             1.0000000        
P   1
  1      0.12503207             1.0000000        
D   1
  1      5.06577134             1.0000000        
D   1
  1      2.09284665             1.0000000        
D   1
  1      0.94065533             1.0000000        
D   1
  1      0.357049665            1.0000000        
F   1
  1      4.0255100              1.0000000        
F   1
  1      1.72258698             1.0000000        
F   1
  1      0.66065149             1.0000000        
G   1
  1      3.15809208             1.0000000        
G   1
  1      1.18578004             1.0000000        
H   1
  1      2.30598008             1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: F
data:
FLUORINE
S   7
  1 201780.46087009             0.0006028        
  2  30898.31903683             0.0021851        
  3   7234.65566591             0.0079153        
  4   2133.14721413             0.0271857        
  5    744.39428028             0.0826675        
  6    290.13277191             0.2351381        
  7    116.64858272             0.6443053        
S   2
  1     47.19151943             0.3838245        
  2     19.55314173             0.6161754        
S   1
  1      8.70784239             1.0000000        
S   1
  1      4.36530031             1.0000000        
S   1
  1      1.47184834             1.0000000        
S   1
  1      0.60999841             1.0000000        
S   1
  1      0.23913194             1.0000000        
P   4
  1    231.17975755             0.0061585        
  2     54.65276977             0.0478132        
  3     17.26226805             0.2258253        
  4      6.27269779             0.7202029        
P   1
  1      2.51607765             1.0000000        
P   1
  1      1.04352047             1.0000000        
P   1
  1      0.4164553              1.0000000        
P   1
  1      0.15408348             1.0000000        
D   1
  1      7.02867366             1.0000000        
D   1
  1      2.83350933             1.0000000        
D   1
  1      1.24473986             1.0000000        
D   1
  1      0.46292793             1.0000000        
F   1
  1      5.2563300              1.0000000        
F   1
  1      2.1856510              1.0000000        
F   1
  1      0.8318480              1.0000000        
G   1
  1      4.2445100              1.0000000        
G   1
  1      1.5368120              1.0000000        
H   1
  1      2.9700500              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Ne
data:
NEON
S   7
  1 296875.44742524             0.0005974        
  2  44216.60957102             0.0021555        
  3  10028.5903458              0.0076896        
  4   2886.29466253             0.0261879        
  5    989.11081384             0.0803438        
  6    377.9855888              0.2343560        
  7    149.63777863             0.6486696        
S   2
  1     60.18439037             0.3820274        
  2     24.93539479             0.6179725        
S   1
  1     11.1400476              1.0000000        
S   1
  1      5.50369978             1.0000000        
S   1
  1      1.86525737             1.0000000        
S   1
  1      0.76856319             1.0000000        
S   1
  1      0.2988420              1.0000000        
P   4
  1    318.41910773             0.0057400        
  2     75.09956976             0.0451629        
  3     23.65165298             0.2202923        
  4      8.54309293             0.7288047        
P   1
  1      3.38222767             1.0000000        
P   1
  1      1.37489687             1.0000000        
P   1
  1      0.53738186             1.0000000        
P   1
  1      0.19398875             1.0000000        
D   1
  1      9.0292000              1.0000000        
D   1
  1      3.5896709              1.0000000        
D   1
  1      1.5631400              1.0000000        
D   1
  1      0.5759500              1.0000000        
F   1
  1      6.8642400              1.0000000        
F   1
  1      2.8212100              1.0000000        
F   1
  1      1.0744450              1.0000000        
G   1
  1      5.3643000              1.0000000        
G   1
  1      1.9073500              1.0000000        
H   1
  1      3.7565000              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Na
data:
SODIUM
S   8
  1 549632.88956726             0.0003904        
  2  84078.05692532             0.0012787        
  3  19869.8060366              0.0040037        
  4   6034.60080773             0.0115259        
  5   2219.80237461             0.0307468        
  6    919.65318407             0.0810400        
  7    381.11593242             0.2355477        
  8    154.92917204             0.6354664        
S   2
  1     64.02898734             0.3982365        
  2     27.49546072             0.6017634        
S   1
  1     12.24878260             1.0000000        
S   1
  1      5.30211534             1.0000000        
S   1
  1      2.54525720             1.0000000        
S   1
  1      1.22127178             1.0000000        
S   1
  1      0.66669525             1.0000000        
S   1
  1      0.36430490             1.0000000        
S   1
  1      0.06226253             1.0000000        
S   1
  1      0.02441244             1.0000000        
P   6
  1    374.93024675             0.0012700        
  2    101.97625581             0.0081168        
  3     34.83908888             0.0360084        
  4     13.18052024             0.1291549        
  5      5.02859188             0.3286461        
  6      1.93351579             0.4968037        
P   1
  1      0.74344536             1.0000000        
P   1
  1      0.28585803             1.0000000        
P   1
  1      0.10991367             1.0000000        
P   1
  1      0.04226229             1.0000000        
P   1
  1      0.01625004             1.0000000        
P   1
  1      0.00624821             1.0000000        
D   1
  1      0.17539870             1.0000000        
D   1
  1      0.09610944             1.0000000        
D   1
  1      0.06080667             1.0000000        
D   1
  1      0.02350536             1.0000000        
F   1
  1      0.17754129             1.0000000        
F   1
  1      0.15190465             1.0000000        
F   1
  1      0.06149322             1.0000000        
G   1
  1      0.17882158             1.0000000        
G   1
  1      0.09136502             1.0000000        
H   1
  1      0.14644453             1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Mg
data:
MAGNESIUM
S   8
  1 664680.24662198             0.0004263        
  2 101432.9255577              0.0013759        
  3  23962.99827352             0.0042176        
  4   7249.00086620             0.0120252        
  5   2624.0997301              0.0326432        
  6   1070.26812425             0.0849913        
  7    449.08814798             0.2373097        
  8    186.14536596             0.6270104        
S   2
  1     77.55001432             0.3967084        
  2     33.08731143             0.6032915        
S   1
  1     15.54003399             1.0000000        
S   1
  1      9.07232004             1.0000000        
S   1
  1      2.74160384             1.0000000        
S   1
  1      1.19347261             1.0000000        
S   1
  1      0.54844488             1.0000000        
S   1
  1      0.1658108              1.0000000        
S   1
  1      0.0788094              1.0000000        
S   1
  1      0.03519519             1.0000000        
P   6
  1    760.28507184             0.0007363        
  2    177.04167496             0.0060058        
  3     55.09346986             0.0324558        
  4     19.66759322             0.1241147        
  5      7.68679148             0.3196104        
  6      3.15554537             0.5170769        
P   1
  1      1.33140257             1.0000000        
P   1
  1      0.57084614             1.0000000        
P   1
  1      0.19432891             1.0000000        
P   1
  1      0.08268454             1.0000000        
P   1
  1      0.03691338             1.0000000        
P   1
  1      0.01704311             1.0000000        
D   1
  1      0.5269100              1.0000000        
D   1
  1      0.1972670              1.0000000        
D   1
  1      0.0887000              1.0000000        
D   1
  1      0.0397450              1.0000000        
F   1
  1      0.9758400              1.0000000        
F   1
  1      0.2531800              1.0000000        
F   1
  1      0.0991000              1.0000000        
G   1
  1      0.2761200              1.0000000        
G   1
  1      0.1109140              1.0000000        
H   1
  1      0.2337090              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Al
data:
ALUMINUM
S   8
  1 935084.3128826              0.0005100        
  2 143677.63413932             0.0015943        
  3  34216.07824186             0.0046789        
  4  10337.94724075             0.0129421        
  5   3718.63965245             0.0343170        
  6   1529.29549568             0.0847503        
  7    655.14416987             0.2324251        
  8    274.16961124             0.6287819        
S   2
  1    114.31556643             0.3708860        
  2     48.8700690              0.6291139        
S   1
  1     22.16547155             1.0000000        
S   1
  1     10.65996031             1.0000000        
S   1
  1      3.7581888              1.0000000        
S   1
  1      1.73170114             1.0000000        
S   1
  1      0.80392817             1.0000000        
S   1
  1      0.26251652             1.0000000        
S   1
  1      0.12016641             1.0000000        
S   1
  1      0.05121355             1.0000000        
P   6
  1   1719.05329755             0.0004784        
  2    409.85069914             0.0035208        
  3    131.97892543             0.0192495        
  4     48.23452641             0.0824586        
  5     18.93324079             0.2725635        
  6      7.85932367             0.6217291        
P   1
  1      3.37486181             1.0000000        
P   1
  1      1.48539679             1.0000000        
P   1
  1      0.65379476             1.0000000        
P   1
  1      0.24507035             1.0000000        
P   1
  1      0.09725269             1.0000000        
P   1
  1      0.03779873             1.0000000        
D   1
  1      0.46583666             1.0000000        
D   1
  1      0.35782033             1.0000000        
D   1
  1      0.17179833             1.0000000        
D   1
  1      0.06652533             1.0000000        
F   1
  1      0.5233130              1.0000000        
F   1
  1      0.3700930              1.0000000        
F   1
  1      0.1502100              1.0000000        
G   1
  1      0.5097610              1.0000000        
G   1
  1      0.2443410              1.0000000        
H   1
  1      0.4206410              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Si
data:
SILICON
S   8
  1 1060955.95691063            0.0006181        
  2 165708.53985054             0.0018184        
  3  41210.72818364             0.0051059        
  4  12685.90175359             0.0137939        
  5   4558.01390332             0.0361749        
  6   1874.38755704             0.0873038        
  7    816.19846826             0.2306374        
  8    346.32280368             0.6245471        
S   2
  1    145.25787168             0.3620614        
  2     62.27886054             0.6379385        
S   1
  1     28.18899929             1.0000000        
S   1
  1     13.25810927             1.0000000        
S   1
  1      4.73484974             1.0000000        
S   1
  1      2.22559522             1.0000000        
S   1
  1      1.04811179             1.0000000        
S   1
  1      0.36794795             1.0000000        
S   1
  1      0.16695352             1.0000000        
S   1
  1      0.07032384             1.0000000        
P   6
  1   1499.38112966             0.0007055        
  2    364.88698717             0.0049642        
  3    121.86861242             0.0246103        
  4     46.72832665             0.0943568        
  5     19.2418339              0.2826327        
  6      8.29104244             0.5927304        
P   1
  1      3.66638816             1.0000000        
P   1
  1      1.64839176             1.0000000        
P   1
  1      0.71589957             1.0000000        
P   1
  1      0.3091828              1.0000000        
P   1
  1      0.12792476             1.0000000        
P   1
  1      0.0512258              1.0000000        
D   1
  1      0.72794666             1.0000000        
D   1
  1      0.33042476             1.0000000        
D   1
  1      0.12462738             1.0000000        
F   1
  1      0.6713710              1.0000000        
F   1
  1      0.4516255              1.0000000        
F   1
  1      0.1902000              1.0000000        
G   1
  1      0.6828200              1.0000000        
G   1
  1      0.3269610              1.0000000        
H   1
  1      0.5690410              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: P
data:
PHOSPHORUS
S   8
  1 1179999.98661496            0.0008856        
  2 194943.06295668             0.0022876        
  3  55576.97387328             0.0055176        
  4  18389.73627886             0.0141413        
  5   6813.84397000             0.0354555        
  6   2831.55905178             0.0837652        
  7   1224.04259121             0.2261995        
  8    511.10472991             0.6317474        
S   2
  1    210.94626554             0.3405914        
  2     89.06075411             0.6594085        
S   1
  1     39.47568423             1.0000000        
S   1
  1     17.8357713              1.0000000        
S   1
  1      6.19322063             1.0000000        
S   1
  1      2.96546309             1.0000000        
S   1
  1      1.39347273             1.0000000        
S   1
  1      0.49388545             1.0000000        
S   1
  1      0.22470427             1.0000000        
S   1
  1      0.09275952             1.0000000        
P   6
  1   1763.67411283             0.0007234        
  2    427.04763107             0.0050508        
  3    142.07960138             0.0250875        
  4     54.65772181             0.0952628        
  5     22.71678698             0.2825208        
  6      9.89513546             0.5913546        
P   1
  1      4.42191244             1.0000000        
P   1
  1      1.99791413             1.0000000        
P   1
  1      0.84967124             1.0000000        
P   1
  1      0.38936311             1.0000000        
P   1
  1      0.16663504             1.0000000        
P   1
  1      0.06770611             1.0000000        
D   1
  1      1.0390390              1.0000000        
D   1
  1      0.4211760              1.0000000        
D   1
  1      0.1608280              1.0000000        
F   1
  1      0.8506790              1.0000000        
F   1
  1      0.5592465              1.0000000        
F   1
  1      0.2426710              1.0000000        
G   1
  1      0.8900800              1.0000000        
G   1
  1      0.4233450              1.0000000        
H   1
  1      0.7404650              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: S
data:
SULFUR
S   8
  1 1212999.21922839            0.0010956        
  2 203576.92852534             0.0027021        
  3  61945.88868383             0.0059508        
  4  21506.7394678              0.0147882        
  5   8116.5730820              0.0366775        
  6   3386.04934479             0.0853211        
  7   1471.43313117             0.2262989        
  8    618.77938709             0.6271655        
S   2
  1    256.38261605             0.3351128        
  2    108.28988434             0.6648871        
S   1
  1     47.75992728             1.0000000        
S   1
  1     21.35368922             1.0000000        
S   1
  1      7.47459101             1.0000000        
S   1
  1      3.63373918             1.0000000        
S   1
  1      1.71216477             1.0000000        
S   1
  1      0.61956519             1.0000000        
S   1
  1      0.28214609             1.0000000        
S   1
  1      0.11682643             1.0000000        
P   6
  1   2271.28493538             0.0006746        
  2    552.81087316             0.0045165        
  3    184.73599046             0.0224855        
  4     70.86191924             0.0881963        
  5     29.16169132             0.2753045        
  6     12.57504775             0.6088225        
P   1
  1      5.57521883             1.0000000        
P   1
  1      2.49784707             1.0000000        
P   1
  1      1.04215054             1.0000000        
P   1
  1      0.47342848             1.0000000        
P   1
  1      0.19908054             1.0000000        
P   1
  1      0.0785522              1.0000000        
D   1
  1      1.23298065             1.0000000        
D   1
  1      0.78380133             1.0000000        
D   1
  1      0.416125665            1.0000000        
D   1
  1      0.15680034             1.0000000        
F   1
  1      1.08536698             1.0000000        
F   1
  1      0.65563349             1.0000000        
F   1
  1      0.2762400              1.0000000        
G   1
  1      1.06238508             1.0000000        
G   1
  1      0.47884254             1.0000000        
H   1
  1      0.87614254             1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Cl
data:
CHLORINE
S   8
  1 1239999.57729787            0.0012264        
  2 210420.39318093             0.0029096        
  3  67964.81345987             0.0058795        
  4  24415.66238126             0.0146471        
  5   9161.00128229             0.0373742        
  6   3715.04258744             0.0894673        
  7   1597.95594775             0.2297121        
  8    680.26304230             0.6187835        
S   2
  1    285.0703131              0.3367665        
  2    121.21790284             0.6632334        
S   1
  1     53.80009801             1.0000000        
S   1
  1     24.20502198             1.0000000        
S   1
  1      8.36684037             1.0000000        
S   1
  1      4.10142477             1.0000000        
S   1
  1      1.97113844             1.0000000        
S   1
  1      0.76887336             1.0000000        
S   1
  1      0.34689176             1.0000000        
S   1
  1      0.1433258              1.0000000        
P   6
  1   2618.33990591             0.0006690        
  2    635.04667448             0.0044196        
  3    210.85882567             0.0222325        
  4     80.32220507             0.0881908        
  5     32.90489855             0.2764019        
  6     14.15944766             0.6080861        
P   1
  1      6.28420241             1.0000000        
P   1
  1      2.82878129             1.0000000        
P   1
  1      1.16523475             1.0000000        
P   1
  1      0.53827439             1.0000000        
P   1
  1      0.23168693             1.0000000        
P   1
  1      0.09264925             1.0000000        
D   1
  1      2.23841833             1.0000000        
D   1
  1      1.11409786             1.0000000        
D   1
  1      0.55642893             1.0000000        
D   1
  1      0.21391866             1.0000000        
F   1
  1      1.3129300              1.0000000        
F   1
  1      0.7885550              1.0000000        
F   1
  1      0.3379800              1.0000000        
G   1
  1      1.3050700              1.0000000        
G   1
  1      0.5807910              1.0000000        
H   1
  1      1.0623500              1.0000000


name: 5ZP-DKH
description: All-electron 5 zeta valence quality plus polarization functions
elt: Ar
data:
ARGON
S   8
  1 1251999.04959334            0.0014431        
  2 213336.65722743             0.0033409        
  3  72643.24239158             0.0061142        
  4  27483.75054174             0.0149258        
  5  10446.66484059             0.0384255        
  6   4209.4380147              0.0920508        
  7   1808.8906232              0.2314278        
  8    776.99019491             0.6122715        
S   2
  1    327.84598593             0.3346814        
  2    139.72156702             0.6653185        
S   1
  1     61.96763869             1.0000000        
S   1
  1     27.80493062             1.0000000        
S   1
  1      9.60192681             1.0000000        
S   1
  1      4.75963151             1.0000000        
S   1
  1      2.3059598              1.0000000        
S   1
  1      0.93089231             1.0000000        
S   1
  1      0.41830002             1.0000000        
S   1
  1      0.17210954             1.0000000        
P   6
  1   2664.10276522             0.0007596        
  2    646.42070990             0.0049684        
  3    215.74263427             0.0244210        
  4     83.08964945             0.0936385        
  5     34.51137758             0.2823025        
  6     15.04706101             0.5939099        
P   1
  1      6.79179336             1.0000000        
P   1
  1      3.1252798              1.0000000        
P   1
  1      1.30375704             1.0000000        
P   1
  1      0.60599797             1.0000000        
P   1
  1      0.26518486             1.0000000        
P   1
  1      0.10762478             1.0000000        
D   1
  1      3.4440409              1.0000000        
D   1
  1      1.4007430              1.0000000        
D   1
  1      0.6905200              1.0000000        
D   1
  1      0.2709110              1.0000000        
F   1
  1      1.5699800              1.0000000        
F   1
  1      0.9499550              1.0000000        
F   1
  1      0.4122600              1.0000000        
G   1
  1      1.5778400              1.0000000        
G   1
  1      0.6979800              1.0000000        
H   1
  1      1.2770940              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: H
data:
HYDROGEN
S   3
  1     18.7311370              0.03349460       
  2      2.8253937              0.23472695       
  3      0.6401217              0.81375733       
S   1
  1      0.1612778              1.0000000        
S   1
  1      0.0360000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Li
data:
LITHIUM
S   6
  1    642.4189200              0.0021426        
  2     96.7985150              0.0162089        
  3     22.0911210              0.0773156        
  4      6.2010703              0.2457860        
  5      1.9351177              0.4701890        
  6      0.6367358              0.3454708        
L   3
  1      2.3249184             -0.0350917              0.0089415        
  2      0.6324306             -0.1912328              0.1410095        
  3      0.0790534              1.0839878              0.9453637        
L   1
  1      0.0359620              1.0000000              1.0000000        
L   1
  1      0.0074000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Be
data:
BERYLLIUM
S   6
  1   1264.5857000              0.0019448        
  2    189.9368100              0.0148351        
  3     43.1590890              0.0720906        
  4     12.0986630              0.2371542        
  5      3.8063232              0.4691987        
  6      1.2728903              0.3565202        
L   3
  1      3.1964631             -0.1126487              0.0559802        
  2      0.7478133             -0.2295064              0.2615506        
  3      0.2199663              1.1869167              0.7939723        
L   1
  1      0.0823099              1.0000000              1.0000000        
L   1
  1      0.0207000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: B
data:
BORON
S   6
  1   2068.8823000              0.0018663        
  2    310.6495700              0.0142515        
  3     70.6830330              0.0695516        
  4     19.8610800              0.2325729        
  5      6.2993048              0.4670787        
  6      2.1270270              0.3634314        
L   3
  1      4.7279710             -0.1303938              0.0745976        
  2      1.1903377             -0.1307889              0.3078467        
  3      0.3594117              1.1309444              0.7434568        
L   1
  1      0.1267512              1.0000000              1.0000000        
L   1
  1      0.0315000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: C
data:
CARBON
S   6
  1   3047.5249000              0.0018347        
  2    457.3695100              0.0140373        
  3    103.9486900              0.0688426        
  4     29.2101550              0.2321844        
  5      9.2866630              0.4679413        
  6      3.1639270              0.3623120        
L   3
  1      7.8682724             -0.1193324              0.0689991        
  2      1.8812885             -0.1608542              0.3164240        
  3      0.5442493              1.1434564              0.7443083        
L   1
  1      0.1687144              1.0000000              1.0000000        
L   1
  1      0.0438000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: N
data:
NITROGEN
S   6
  1   4173.5110000              0.0018348        
  2    627.4579000              0.0139950        
  3    142.9021000              0.0685870        
  4     40.2343300              0.2322410        
  5     12.8202100              0.4690700        
  6      4.3904370              0.3604550        
L   3
  1     11.6263580             -0.1149610              0.0675800        
  2      2.7162800             -0.1691180              0.3239070        
  3      0.7722180              1.1458520              0.7408950        
L   1
  1      0.2120313              1.0000000              1.0000000        
L   1
  1      0.0639000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: O
data:
OXYGEN
S   6
  1   5484.6717000              0.0018311        
  2    825.2349500              0.0139501        
  3    188.0469600              0.0684451        
  4     52.9645000              0.2327143        
  5     16.8975700              0.4701930        
  6      5.7996353              0.3585209        
L   3
  1     15.5396160             -0.1107775              0.0708743        
  2      3.5999336             -0.1480263              0.3397528        
  3      1.0137618              1.1307670              0.7271586        
L   1
  1      0.2700058              1.0000000              1.0000000        
L   1
  1      0.0845000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: F
data:
FLUORINE
S   6
  1   7001.7130900              0.0018196169     
  2   1051.3660900              0.0139160796     
  3    239.2856900              0.0684053245     
  4     67.3974453              0.233185760      
  5     21.5199573              0.471267439      
  6      7.40310130             0.356618546      
L   3
  1     20.8479528             -0.108506975            0.0716287243     
  2      4.80830834            -0.146451658            0.3459121030     
  3      1.34406986             1.128688580            0.7224699570     
L   1
  1      0.358151393            1.0000000              1.0000000        
L   1
  1      0.1076000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ne
data:
NEON
S   6
  1   8425.8515300              0.0018843481     
  2   1268.5194000              0.0143368994     
  3    289.6214140              0.0701096233     
  4     81.8590040              0.2373732660     
  5     26.2515079              0.4730071260     
  6      9.09472051             0.3484012410     
L   3
  1     26.5321310             -0.107118287            0.0719095885     
  2      6.10175501            -0.146163821            0.3495133720     
  3      1.69627153             1.127773500            0.7199405120     
L   1
  1      0.44581870             1.0000000              1.0000000        
L   1
  1      0.1300000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Na
data:
SODIUM
S   6
  1   9993.2000000              0.0019377        
  2   1499.8900000              0.0148070        
  3    341.9510000              0.0727060        
  4     94.6797000              0.2526290        
  5     29.7345000              0.4932420        
  6     10.0063000              0.3131690        
L   6
  1    150.9630000             -0.0035421              0.0050017        
  2     35.5878000             -0.0439590              0.0355110        
  3     11.1683000             -0.1097521              0.1428250        
  4      3.9020100              0.1873980              0.3386200        
  5      1.3817700              0.6466990              0.4515790        
  6      0.4663820              0.3060580              0.2732710        
L   3
  1      0.4979660             -0.2485030             -0.0230230        
  2      0.0843530             -0.1317040              0.9503590        
  3      0.0666350              1.2335200              0.0598580        
L   1
  1      0.0259544              1.0000000              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Mg
data:
MAGNESIUM
S   6
  1  11722.8000000              0.0019778        
  2   1759.9300000              0.0151140        
  3    400.8460000              0.0739110        
  4    112.8070000              0.2491910        
  5     35.9997000              0.4879280        
  6     12.1828000              0.3196620        
L   6
  1    189.1800000             -0.0032372              0.0049281        
  2     45.2119000             -0.0410080              0.0349890        
  3     14.3563000             -0.1126000              0.1407250        
  4      5.1388600              0.1486330              0.3336420        
  5      1.9065200              0.6164970              0.4449400        
  6      0.7058870              0.3648290              0.2692540        
L   3
  1      0.9293400             -0.2122900             -0.0224190        
  2      0.2690350             -0.1079850              0.1922700        
  3      0.1173790              1.1758400              0.8461810        
L   1
  1      0.0421061              1.0000000              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Al
data:
ALUMINUM
S   6
  1  13983.1000000              0.00194267       
  2   2098.7500000              0.0148599        
  3    477.7050000              0.0728494        
  4    134.3600000              0.2468300        
  5     42.8709000              0.4872580        
  6     14.5189000              0.3234960        
L   6
  1    239.6680000             -0.00292619             0.00460285       
  2     57.4419000             -0.0374080              0.0331990        
  3     18.2859000             -0.1144870              0.1362820        
  4      6.5991400              0.1156350              0.3304760        
  5      2.4904900              0.6125950              0.4491460        
  6      0.9445400              0.3937990              0.2657040        
L   3
  1      1.2779000             -0.2276060             -0.0175130        
  2      0.3975900              0.00144583             0.2445330        
  3      0.1600950              1.0927900              0.8049340        
L   1
  1      0.0556577              1.0000000              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Si
data:
SILICON
S   6
  1  16115.9000000              0.00195948       
  2   2425.5800000              0.01492880       
  3    553.8670000              0.07284780       
  4    156.3400000              0.24613000       
  5     50.0683000              0.48591400       
  6     17.0178000              0.32500200       
L   6
  1    292.7180000             -0.00278094             0.00443826       
  2     69.8731000             -0.03571460             0.03266790       
  3     22.3363000             -0.11498500             0.13472100       
  4      8.1503900              0.09356340             0.32867800       
  5      3.1345800              0.60301700             0.44964000       
  6      1.2254300              0.41895900             0.26137200       
L   3
  1      1.7273800             -0.24463000            -0.01779510       
  2      0.5729220              0.00431572             0.25353900       
  3      0.2221920              1.09818000             0.80066900       
L   1
  1      0.0778369              1.00000000             1.00000000       
L   1
  1      0.0331000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: P
data:
PHOSPHORUS
S   6
  1  19413.3000000              0.0018516        
  2   2909.4200000              0.0142062        
  3    661.3640000              0.0699995        
  4    185.7590000              0.2400790        
  5     59.1943000              0.4847620        
  6     20.0310000              0.3352000        
L   6
  1    339.4780000             -0.00278217             0.00456462       
  2     81.0101000             -0.0360499              0.03369360       
  3     25.8780000             -0.1166310              0.13975500       
  4      9.4522100              0.0968328              0.33936200       
  5      3.6656600              0.6144180              0.45092100       
  6      1.4674600              0.4037980              0.23858600       
L   3
  1      2.1562300             -0.2529230             -0.01776530       
  2      0.7489970              0.0328517              0.27405800       
  3      0.2831450              1.0812500              0.78542100       
L   1
  1      0.0998317              1.0000000              1.00000000       
L   1
  1      0.0348000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: S
data:
SULFUR
S   6
  1  21917.1000000              0.0018690        
  2   3301.4900000              0.0142300        
  3    754.1460000              0.0696960        
  4    212.7110000              0.2384870        
  5     67.9896000              0.4833070        
  6     23.0515000              0.3380740        
L   6
  1    423.7350000             -0.0023767              0.0040610        
  2    100.7100000             -0.0316930              0.0306810        
  3     32.1599000             -0.1133170              0.1304520        
  4     11.8079000              0.0560900              0.3272050        
  5      4.6311000              0.5922550              0.4528510        
  6      1.8702500              0.4550060              0.2560420        
L   3
  1      2.6158400             -0.2503740             -0.0145110        
  2      0.9221670              0.0669570              0.3102630        
  3      0.3412870              1.0545100              0.7544830        
L   1
  1      0.1171670              1.0000000              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Cl
data:
CHLORINE
S   6
  1  25180.1000000              0.0018330        
  2   3780.3500000              0.0140340        
  3    860.4740000              0.0690970        
  4    242.1450000              0.2374520        
  5     77.3349000              0.4830340        
  6     26.2470000              0.3398560        
L   6
  1    491.7650000             -0.0022974              0.0039894        
  2    116.9840000             -0.0307140              0.0303180        
  3     37.4153000             -0.1125280              0.1298800        
  4     13.7834000              0.0450160              0.3279510        
  5      5.4521500              0.5893530              0.4535270        
  6      2.2258800              0.4652060              0.2521540        
L   3
  1      3.1864900             -0.2518300             -0.0142990        
  2      1.1442700              0.0615890              0.3235720        
  3      0.4203770              1.0601800              0.7435070        
L   1
  1      0.1426570              1.0000000              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ar
data:
ARGON
S   6
  1  28348.3000000              0.00182526       
  2   4257.6200000              0.01396860       
  3    969.8570000              0.06870730       
  4    273.2630000              0.23620400       
  5     87.3695000              0.48221400       
  6     29.6867000              0.34204300       
L   6
  1    575.8910000             -0.00215972             0.00380665       
  2    136.8160000             -0.02907750             0.02923050       
  3     43.8098000             -0.11082700             0.12646700       
  4     16.2094000              0.02769990             0.32351000       
  5      6.4608400              0.57761300             0.45489600       
  6      2.6511400              0.48868800             0.25663000       
L   3
  1      3.8602800             -0.2555920             -0.01591970       
  2      1.4137300              0.0378066              0.32464600       
  3      0.5166460              1.0805600              0.74399000       
L   1
  1      0.1738880              1.0000000              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: K
data:
POTASSIUM
S   6
  1  31594.4200000              1.828010E-03     
  2   4744.3300000              1.399403E-02     
  3   1080.4190000              6.887129E-02     
  4    304.2338000              2.369760E-01     
  5     97.2458600              4.829040E-01     
  6     33.0249500              3.404795E-01     
L   6
  1    622.7625000             -2.502976E-03           4.094637E-03     
  2    147.8839000             -3.315550E-02           3.145199E-02     
  3     47.3273500             -1.226387E-01           1.351558E-01     
  4     17.5149500              5.353643E-02           3.390500E-01     
  5      6.9227220              6.193860E-01           4.629455E-01     
  6      2.7682770              4.345878E-01           2.242638E-01     
L   6
  1     11.8480200              1.277689E-02          -1.221377E-02     
  2      4.0792110              2.098767E-01          -6.900537E-03     
  3      1.7634810             -3.095274E-03           2.007466E-01     
  4      0.7889270             -5.593884E-01           4.281332E-01     
  5      0.3503870             -5.134760E-01           3.970156E-01     
  6      0.1463440             -6.598035E-02           1.104718E-01     
L   3
  1      0.7168010             -5.237772E-02           0.0316430        
  2      0.2337410             -2.798503E-01          -0.0404616        
  3      0.0386750              1.141547E+00           1.0120290        
L   1
  1      0.0165210              1.000000E+00           1.00000000       
L   1
  1      0.0047000              1.0000000              1.0000000


name: 6-31++G
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ca
data:
CALCIUM
S   6
  1  35264.8600000              1.813501E-03     
  2   5295.5030000              1.388493E-02     
  3   1206.0200000              6.836162E-02     
  4    339.6839000              2.356188E-01     
  5    108.6264000              4.820639E-01     
  6     36.9210300              3.429819E-01     
L   6
  1    706.3096000              2.448225E-03           4.020371E-03     
  2    167.8187000              3.241504E-02           3.100601E-02     
  3     53.8255800              1.226219E-01           1.337279E-01     
  4     20.0163800             -4.316965E-02           3.367983E-01     
  5      7.9702790             -6.126995E-01           4.631281E-01     
  6      3.2120590             -4.487540E-01           2.257532E-01     
L   6
  1     14.1951800              1.084500E-02          -1.289621E-02     
  2      4.8808280              2.088333E-01          -1.025198E-02     
  3      2.1603900              3.150338E-02           1.959781E-01     
  4      0.9878990             -5.526518E-01           4.357933E-01     
  5      0.4495170             -5.437997E-01           3.996452E-01     
  6      0.1873870             -6.669342E-02           9.713636E-02     
L   3
  1      1.0322710             -4.439720E-02          -0.4298621        
  2      0.3811710             -3.284563E-01           0.006935829      
  3      0.0651310              1.163010E+00           0.9705933        
L   1
  1      0.0260100              1.000000E+00           1.00000000       
L   1
  1      0.0071000              1.0000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Li
data:
LITHIUM
S   6
  1    642.4189200              0.0021426        
  2     96.7985150              0.0162089        
  3     22.0911210              0.0773156        
  4      6.2010703              0.2457860        
  5      1.9351177              0.4701890        
  6      0.6367358              0.3454708        
L   3
  1      2.3249184             -0.0350917              0.0089415        
  2      0.6324306             -0.1912328              0.1410095        
  3      0.0790534              1.0839878              0.9453637        
L   1
  1      0.0359620              1.0000000              1.0000000        
L   1
  1      0.0074000              1.0000000              1.0000000        
D   1
  1      0.2000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Be
data:
BERYLLIUM
S   6
  1   1264.5857000              0.0019448        
  2    189.9368100              0.0148351        
  3     43.1590890              0.0720906        
  4     12.0986630              0.2371542        
  5      3.8063232              0.4691987        
  6      1.2728903              0.3565202        
L   3
  1      3.1964631             -0.1126487              0.0559802        
  2      0.7478133             -0.2295064              0.2615506        
  3      0.2199663              1.1869167              0.7939723        
L   1
  1      0.0823099              1.0000000              1.0000000        
L   1
  1      0.0207000              1.0000000              1.0000000        
D   1
  1      0.4000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: B
data:
BORON
S   6
  1   2068.8823000              0.0018663        
  2    310.6495700              0.0142515        
  3     70.6830330              0.0695516        
  4     19.8610800              0.2325729        
  5      6.2993048              0.4670787        
  6      2.1270270              0.3634314        
L   3
  1      4.7279710             -0.1303938              0.0745976        
  2      1.1903377             -0.1307889              0.3078467        
  3      0.3594117              1.1309444              0.7434568        
L   1
  1      0.1267512              1.0000000              1.0000000        
L   1
  1      0.0315000              1.0000000              1.0000000        
D   1
  1      0.6000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: C
data:
CARBON
S   6
  1   3047.5249000              0.0018347        
  2    457.3695100              0.0140373        
  3    103.9486900              0.0688426        
  4     29.2101550              0.2321844        
  5      9.2866630              0.4679413        
  6      3.1639270              0.3623120        
L   3
  1      7.8682724             -0.1193324              0.0689991        
  2      1.8812885             -0.1608542              0.3164240        
  3      0.5442493              1.1434564              0.7443083        
L   1
  1      0.1687144              1.0000000              1.0000000        
L   1
  1      0.0438000              1.0000000              1.0000000        
D   1
  1      0.8000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: N
data:
NITROGEN
S   6
  1   4173.5110000              0.0018348        
  2    627.4579000              0.0139950        
  3    142.9021000              0.0685870        
  4     40.2343300              0.2322410        
  5     12.8202100              0.4690700        
  6      4.3904370              0.3604550        
L   3
  1     11.6263580             -0.1149610              0.0675800        
  2      2.7162800             -0.1691180              0.3239070        
  3      0.7722180              1.1458520              0.7408950        
L   1
  1      0.2120313              1.0000000              1.0000000        
L   1
  1      0.0639000              1.0000000              1.0000000        
D   1
  1      0.8000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: O
data:
OXYGEN
S   6
  1   5484.6717000              0.0018311        
  2    825.2349500              0.0139501        
  3    188.0469600              0.0684451        
  4     52.9645000              0.2327143        
  5     16.8975700              0.4701930        
  6      5.7996353              0.3585209        
L   3
  1     15.5396160             -0.1107775              0.0708743        
  2      3.5999336             -0.1480263              0.3397528        
  3      1.0137618              1.1307670              0.7271586        
L   1
  1      0.2700058              1.0000000              1.0000000        
L   1
  1      0.0845000              1.0000000              1.0000000        
D   1
  1      0.8000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: F
data:
FLUORINE
S   6
  1   7001.7130900              0.0018196169     
  2   1051.3660900              0.0139160796     
  3    239.2856900              0.0684053245     
  4     67.3974453              0.233185760      
  5     21.5199573              0.471267439      
  6      7.40310130             0.356618546      
L   3
  1     20.8479528             -0.108506975            0.0716287243     
  2      4.80830834            -0.146451658            0.3459121030     
  3      1.34406986             1.128688580            0.7224699570     
L   1
  1      0.358151393            1.0000000              1.0000000        
L   1
  1      0.1076000              1.0000000              1.0000000        
D   1
  1      0.8000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ne
data:
NEON
S   6
  1   8425.8515300              0.0018843481     
  2   1268.5194000              0.0143368994     
  3    289.6214140              0.0701096233     
  4     81.8590040              0.2373732660     
  5     26.2515079              0.4730071260     
  6      9.09472051             0.3484012410     
L   3
  1     26.5321310             -0.107118287            0.0719095885     
  2      6.10175501            -0.146163821            0.3495133720     
  3      1.69627153             1.127773500            0.7199405120     
L   1
  1      0.44581870             1.0000000              1.0000000        
L   1
  1      0.1300000              1.0000000              1.0000000        
D   1
  1      0.8000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Na
data:
SODIUM
S   6
  1   9993.2000000              0.0019377        
  2   1499.8900000              0.0148070        
  3    341.9510000              0.0727060        
  4     94.6797000              0.2526290        
  5     29.7345000              0.4932420        
  6     10.0063000              0.3131690        
L   6
  1    150.9630000             -0.0035421              0.0050017        
  2     35.5878000             -0.0439590              0.0355110        
  3     11.1683000             -0.1097521              0.1428250        
  4      3.9020100              0.1873980              0.3386200        
  5      1.3817700              0.6466990              0.4515790        
  6      0.4663820              0.3060580              0.2732710        
L   3
  1      0.4979660             -0.2485030             -0.0230230        
  2      0.0843530             -0.1317040              0.9503590        
  3      0.0666350              1.2335200              0.0598580        
L   1
  1      0.0259544              1.0000000              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Mg
data:
MAGNESIUM
S   6
  1  11722.8000000              0.0019778        
  2   1759.9300000              0.0151140        
  3    400.8460000              0.0739110        
  4    112.8070000              0.2491910        
  5     35.9997000              0.4879280        
  6     12.1828000              0.3196620        
L   6
  1    189.1800000             -0.0032372              0.0049281        
  2     45.2119000             -0.0410080              0.0349890        
  3     14.3563000             -0.1126000              0.1407250        
  4      5.1388600              0.1486330              0.3336420        
  5      1.9065200              0.6164970              0.4449400        
  6      0.7058870              0.3648290              0.2692540        
L   3
  1      0.9293400             -0.2122900             -0.0224190        
  2      0.2690350             -0.1079850              0.1922700        
  3      0.1173790              1.1758400              0.8461810        
L   1
  1      0.0421061              1.0000000              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Al
data:
ALUMINUM
S   6
  1  13983.1000000              0.00194267       
  2   2098.7500000              0.0148599        
  3    477.7050000              0.0728494        
  4    134.3600000              0.2468300        
  5     42.8709000              0.4872580        
  6     14.5189000              0.3234960        
L   6
  1    239.6680000             -0.00292619             0.00460285       
  2     57.4419000             -0.0374080              0.0331990        
  3     18.2859000             -0.1144870              0.1362820        
  4      6.5991400              0.1156350              0.3304760        
  5      2.4904900              0.6125950              0.4491460        
  6      0.9445400              0.3937990              0.2657040        
L   3
  1      1.2779000             -0.2276060             -0.0175130        
  2      0.3975900              0.00144583             0.2445330        
  3      0.1600950              1.0927900              0.8049340        
L   1
  1      0.0556577              1.0000000              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000        
D   1
  1      0.3250000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Si
data:
SILICON
S   6
  1  16115.9000000              0.00195948       
  2   2425.5800000              0.01492880       
  3    553.8670000              0.07284780       
  4    156.3400000              0.24613000       
  5     50.0683000              0.48591400       
  6     17.0178000              0.32500200       
L   6
  1    292.7180000             -0.00278094             0.00443826       
  2     69.8731000             -0.03571460             0.03266790       
  3     22.3363000             -0.11498500             0.13472100       
  4      8.1503900              0.09356340             0.32867800       
  5      3.1345800              0.60301700             0.44964000       
  6      1.2254300              0.41895900             0.26137200       
L   3
  1      1.7273800             -0.24463000            -0.01779510       
  2      0.5729220              0.00431572             0.25353900       
  3      0.2221920              1.09818000             0.80066900       
L   1
  1      0.0778369              1.00000000             1.00000000       
L   1
  1      0.0331000              1.0000000              1.0000000        
D   1
  1      0.4500000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: P
data:
PHOSPHORUS
S   6
  1  19413.3000000              0.0018516        
  2   2909.4200000              0.0142062        
  3    661.3640000              0.0699995        
  4    185.7590000              0.2400790        
  5     59.1943000              0.4847620        
  6     20.0310000              0.3352000        
L   6
  1    339.4780000             -0.00278217             0.00456462       
  2     81.0101000             -0.0360499              0.03369360       
  3     25.8780000             -0.1166310              0.13975500       
  4      9.4522100              0.0968328              0.33936200       
  5      3.6656600              0.6144180              0.45092100       
  6      1.4674600              0.4037980              0.23858600       
L   3
  1      2.1562300             -0.2529230             -0.01776530       
  2      0.7489970              0.0328517              0.27405800       
  3      0.2831450              1.0812500              0.78542100       
L   1
  1      0.0998317              1.0000000              1.00000000       
L   1
  1      0.0348000              1.0000000              1.0000000        
D   1
  1      0.5500000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: S
data:
SULFUR
S   6
  1  21917.1000000              0.0018690        
  2   3301.4900000              0.0142300        
  3    754.1460000              0.0696960        
  4    212.7110000              0.2384870        
  5     67.9896000              0.4833070        
  6     23.0515000              0.3380740        
L   6
  1    423.7350000             -0.0023767              0.0040610        
  2    100.7100000             -0.0316930              0.0306810        
  3     32.1599000             -0.1133170              0.1304520        
  4     11.8079000              0.0560900              0.3272050        
  5      4.6311000              0.5922550              0.4528510        
  6      1.8702500              0.4550060              0.2560420        
L   3
  1      2.6158400             -0.2503740             -0.0145110        
  2      0.9221670              0.0669570              0.3102630        
  3      0.3412870              1.0545100              0.7544830        
L   1
  1      0.1171670              1.0000000              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      0.6500000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Cl
data:
CHLORINE
S   6
  1  25180.1000000              0.0018330        
  2   3780.3500000              0.0140340        
  3    860.4740000              0.0690970        
  4    242.1450000              0.2374520        
  5     77.3349000              0.4830340        
  6     26.2470000              0.3398560        
L   6
  1    491.7650000             -0.0022974              0.0039894        
  2    116.9840000             -0.0307140              0.0303180        
  3     37.4153000             -0.1125280              0.1298800        
  4     13.7834000              0.0450160              0.3279510        
  5      5.4521500              0.5893530              0.4535270        
  6      2.2258800              0.4652060              0.2521540        
L   3
  1      3.1864900             -0.2518300             -0.0142990        
  2      1.1442700              0.0615890              0.3235720        
  3      0.4203770              1.0601800              0.7435070        
L   1
  1      0.1426570              1.0000000              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      0.7500000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ar
data:
ARGON
S   6
  1  28348.3000000              0.00182526       
  2   4257.6200000              0.01396860       
  3    969.8570000              0.06870730       
  4    273.2630000              0.23620400       
  5     87.3695000              0.48221400       
  6     29.6867000              0.34204300       
L   6
  1    575.8910000             -0.00215972             0.00380665       
  2    136.8160000             -0.02907750             0.02923050       
  3     43.8098000             -0.11082700             0.12646700       
  4     16.2094000              0.02769990             0.32351000       
  5      6.4608400              0.57761300             0.45489600       
  6      2.6511400              0.48868800             0.25663000       
L   3
  1      3.8602800             -0.2555920             -0.01591970       
  2      1.4137300              0.0378066              0.32464600       
  3      0.5166460              1.0805600              0.74399000       
L   1
  1      0.1738880              1.0000000              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000        
D   1
  1      0.8500000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: K
data:
POTASSIUM
S   6
  1  31594.4200000              1.828010E-03     
  2   4744.3300000              1.399403E-02     
  3   1080.4190000              6.887129E-02     
  4    304.2338000              2.369760E-01     
  5     97.2458600              4.829040E-01     
  6     33.0249500              3.404795E-01     
L   6
  1    622.7625000             -2.502976E-03           4.094637E-03     
  2    147.8839000             -3.315550E-02           3.145199E-02     
  3     47.3273500             -1.226387E-01           1.351558E-01     
  4     17.5149500              5.353643E-02           3.390500E-01     
  5      6.9227220              6.193860E-01           4.629455E-01     
  6      2.7682770              4.345878E-01           2.242638E-01     
L   6
  1     11.8480200              1.277689E-02          -1.221377E-02     
  2      4.0792110              2.098767E-01          -6.900537E-03     
  3      1.7634810             -3.095274E-03           2.007466E-01     
  4      0.7889270             -5.593884E-01           4.281332E-01     
  5      0.3503870             -5.134760E-01           3.970156E-01     
  6      0.1463440             -6.598035E-02           1.104718E-01     
L   3
  1      0.7168010             -5.237772E-02           0.0316430        
  2      0.2337410             -2.798503E-01          -0.0404616        
  3      0.0386750              1.141547E+00           1.0120290        
L   1
  1      0.0165210              1.000000E+00           1.00000000       
L   1
  1      0.0047000              1.0000000              1.0000000        
D   1
  1      0.2000000              1.0000000


name: 6-31++G*
description: VDZD Valence Double Zeta + Diffuse Functions on All Atoms
elt: Ca
data:
CALCIUM
S   6
  1  35264.8600000              1.813501E-03     
  2   5295.5030000              1.388493E-02     
  3   1206.0200000              6.836162E-02     
  4    339.6839000              2.356188E-01     
  5    108.6264000              4.820639E-01     
  6     36.9210300              3.429819E-01     
L   6
  1    706.3096000              2.448225E-03           4.020371E-03     
  2    167.8187000              3.241504E-02           3.100601E-02     
  3     53.8255800              1.226219E-01           1.337279E-01     
  4     20.0163800             -4.316965E-02           3.367983E-01     
  5      7.9702790             -6.126995E-01           4.631281E-01     
  6      3.2120590             -4.487540E-01           2.257532E-01     
L   6
  1     14.1951800              1.084500E-02          -1.289621E-02     
  2      4.8808280              2.088333E-01          -1.025198E-02     
  3      2.1603900              3.150338E-02           1.959781E-01     
  4      0.9878990             -5.526518E-01           4.357933E-01     
  5      0.4495170             -5.437997E-01           3.996452E-01     
  6      0.1873870             -6.669342E-02           9.713636E-02     
L   3
  1      1.0322710             -4.439720E-02          -0.4298621        
  2      0.3811710             -3.284563E-01           0.006935829      
  3      0.0651310              1.163010E+00           0.9705933        
L   1
  1      0.0260100              1.000000E+00           1.00000000       
L   1
  1      0.0071000              1.0000000              1.0000000        
D   1
  1      0.2000000              1.0000000


name: 6-31++G**
description: VDZPD Valence Double Zeta + Diffuse and Polarization Functions
elt: H
data:
HYDROGEN
S   3
  1     18.7311370              0.03349460       
  2      2.8253937              0.23472695       
  3      0.6401217              0.81375733       
S   1
  1      0.1612778              1.0000000        
S   1
  1      0.0360000              1.0000000        
P   1
  1      1.1000000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: H
data:
HYDROGEN
S   3
  1     33.8650000              0.0254938        
  2      5.0947900              0.1903730        
  3      1.1587900              0.8521610        
S   1
  1      0.3258400              1.0000000        
S   1
  1      0.1027410              1.0000000        
S   1
  1      0.0360000              1.0000000        
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   6
  1    900.4600000              0.00228704       
  2    134.4330000              0.0176350        
  3     30.4365000              0.0873434        
  4      8.6263900              0.2809770        
  5      2.4833200              0.6587410        
  6      0.3031790              0.1187120        
L   3
  1      4.8689000              0.0933293              0.0327661        
  2      0.8569240              0.9430450              0.1597920        
  3      0.2432270             -0.00279827             0.8856670        
L   1
  1      0.0635070              1.0000000              1.0000000        
L   1
  1      0.0243683              1.0000000              1.0000000        
L   1
  1      0.0074000              1.0000000              1.0000000        
D   1
  1      0.4000000              1.0000000        
D   1
  1      0.1000000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   6
  1   1682.8000000              0.00228574       
  2    251.7150000              0.0175938        
  3     57.4116000              0.0863315        
  4     16.5171000              0.2818350        
  5      4.8536400              0.6405940        
  6      0.6268630              0.1444670        
L   3
  1      8.3093800              0.1086210              0.0361344        
  2      1.7407500              0.9273010              0.2169580        
  3      0.4858160             -0.00297169             0.8418390        
L   1
  1      0.1636130              1.0000000              1.0000000        
L   1
  1      0.0567285              1.0000000              1.0000000        
L   1
  1      0.0207000              1.0000000              1.0000000        
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1275000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: B
data:
BORON
S   6
  1   2858.8900000              0.00215375       
  2    428.1400000              0.0165823        
  3     97.5282000              0.0821870        
  4     27.9693000              0.2766180        
  5      8.2157700              0.6293160        
  6      1.1127800              0.1737700        
L   3
  1     13.2415000              0.1174430              0.0418100        
  2      3.0016600              0.9180020              0.2365750        
  3      0.9128560             -0.00265105             0.8162140        
L   1
  1      0.3154540              1.0000000              1.0000000        
L   1
  1      0.0988563              1.0000000              1.0000000        
L   1
  1      0.0315000              1.0000000              1.0000000        
D   1
  1      0.8020000              1.0000000        
D   1
  1      0.2005000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: C
data:
CARBON
S   6
  1   4563.2400000              0.00196665       
  2    682.0240000              0.0152306        
  3    154.9730000              0.0761269        
  4     44.4553000              0.2608010        
  5     13.0290000              0.6164620        
  6      1.8277300              0.2210060        
L   3
  1     20.9642000              0.1146600              0.0402487        
  2      4.8033100              0.9199990              0.2375940        
  3      1.4593300             -0.00303068             0.8158540        
L   1
  1      0.4834560              1.0000000              1.0000000        
L   1
  1      0.1455850              1.0000000              1.0000000        
L   1
  1      0.0438000              1.0000000              1.0000000        
D   1
  1      1.2520000              1.0000000        
D   1
  1      0.3130000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: N
data:
NITROGEN
S   6
  1   6293.4800000              0.00196979       
  2    949.0440000              0.0149613        
  3    218.7760000              0.0735006        
  4     63.6916000              0.2489370        
  5     18.8282000              0.6024600        
  6      2.7202300              0.2562020        
L   3
  1     30.6331000              0.1119060              0.0383119        
  2      7.0261400              0.9216660              0.2374030        
  3      2.1120500             -0.00256919             0.8175920        
L   1
  1      0.6840090              1.0000000              1.0000000        
L   1
  1      0.2008780              1.0000000              1.0000000        
L   1
  1      0.0639000              1.0000000              1.0000000        
D   1
  1      1.8260000              1.0000000        
D   1
  1      0.4565000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: O
data:
OXYGEN
S   6
  1   8588.5000000              0.00189515       
  2   1297.2300000              0.0143859        
  3    299.2960000              0.0707320        
  4     87.3771000              0.2400010        
  5     25.6789000              0.5947970        
  6      3.7400400              0.2808020        
L   3
  1     42.1175000              0.1138890              0.0365114        
  2      9.6283700              0.9208110              0.2371530        
  3      2.8533200             -0.00327447             0.8197020        
L   1
  1      0.9056610              1.0000000              1.0000000        
L   1
  1      0.2556110              1.0000000              1.0000000        
L   1
  1      0.0845000              1.0000000              1.0000000        
D   1
  1      2.5840000              1.0000000        
D   1
  1      0.6460000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: F
data:
FLUORINE
S   6
  1  11427.1000000              0.00180093       
  2   1722.3500000              0.0137419        
  3    395.7460000              0.0681334        
  4    115.1390000              0.2333250        
  5     33.6026000              0.5890860        
  6      4.9190100              0.2995050        
L   3
  1     55.4441000              0.1145360              0.0354609        
  2     12.6323000              0.9205120              0.2374510        
  3      3.7175600             -0.00337804             0.8204580        
L   1
  1      1.1654500              1.0000000              1.0000000        
L   1
  1      0.3218920              1.0000000              1.0000000        
L   1
  1      0.1076000              1.0000000              1.0000000        
D   1
  1      3.5000000              1.0000000        
D   1
  1      0.8750000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Ne
data:
NEON
S   6
  1  13995.7000000              0.00183276       
  2   2117.1000000              0.0138827        
  3    490.4250000              0.0680687        
  4    143.8330000              0.2313280        
  5     41.9265000              0.5858900        
  6      6.1568400              0.3058830        
L   3
  1     69.1211000              0.1191490              0.0356574        
  2     15.8350000              0.9173750              0.2394770        
  3      4.6732600             -0.00405839             0.8184610        
L   1
  1      1.4575600              1.0000000              1.0000000        
L   1
  1      0.3970570              1.0000000              1.0000000        
L   1
  1      0.1300000              1.0000000              1.0000000        
D   1
  1      4.6080000              1.0000000        
D   1
  1      1.1520000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Na
data:
SODIUM
S   6
  1  36166.4000000              0.0010320        
  2   5372.5800000              0.0080710        
  3   1213.2100000              0.0421290        
  4    339.6230000              0.1697890        
  5    109.5530000              0.5146210        
  6     38.7773000              0.3798170        
S   3
  1     38.7773000              0.3747620        
  2     14.5759000              0.5757690        
  3      5.2699300              0.1129330        
S   1
  1      1.8277700              1.0000000        
S   1
  1      0.6199480              1.0000000        
S   1
  1      0.0572400              1.0000000        
S   1
  1      0.0240480              1.0000000        
P   4
  1    144.6450000              0.0114850        
  2     33.9074000              0.0823830        
  3     10.6285000              0.3196580        
  4      3.8238900              0.7012950        
P   2
  1      1.4442900              0.6385060        
  2      0.5526210              0.4253650        
P   1
  1      0.1887200              1.0000000        
P   1
  1      0.0465010              1.0000000        
P   1
  1      0.0162850              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000        
D   1
  1      0.3500000              1.0000000        
D   1
  1      0.0875000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   6
  1  43866.5000000              0.0009180        
  2   6605.3700000              0.0070470        
  3   1513.2600000              0.0359410        
  4    432.3170000              0.1414610        
  5    142.1490000              0.4267640        
  6     51.3983000              0.4979750        
S   3
  1     51.3983000              0.2513550        
  2     19.9196000              0.6186710        
  3      8.0247400              0.1884170        
S   1
  1      2.5081700              1.0000000        
S   1
  1      0.8715310              1.0000000        
S   1
  1      0.1081880              1.0000000        
S   1
  1      0.0401300              1.0000000        
P   4
  1    193.8540000              0.0101880        
  2     45.4420000              0.0753600        
  3     14.1864000              0.3074190        
  4      5.0575100              0.7175750        
P   2
  1      1.8886100              0.6673390        
  2      0.7226520              0.3946490        
P   1
  1      0.2364170              1.0000000        
P   1
  1      0.0933580              1.0000000        
P   1
  1      0.0348090              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000        
D   1
  1      0.3500000              1.0000000        
D   1
  1      0.0875000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   6
  1  54866.4890000              0.0008390        
  2   8211.7665000              0.0065270        
  3   1866.1761000              0.0336660        
  4    531.1293400              0.1329020        
  5    175.1179700              0.4012660        
  6     64.0055000              0.5313380        
S   3
  1     64.0055000              0.2023050        
  2     25.2925070              0.6247900        
  3     10.5349100              0.2274390        
S   1
  1      3.2067110              1.0000000        
S   1
  1      1.1525550              1.0000000        
S   1
  1      0.1766780              1.0000000        
S   1
  1      0.0652370              1.0000000        
P   4
  1    259.2836200              0.0094480        
  2     61.0768700              0.0709740        
  3     19.3032370              0.2956360        
  4      7.0108820              0.7282190        
P   2
  1      2.6738650              0.6444670        
  2      1.0365960              0.4174130        
P   1
  1      0.3168190              1.0000000        
P   1
  1      0.1142570              1.0000000        
P   1
  1      0.0413970              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000        
D   1
  1      0.6500000              1.0000000        
D   1
  1      0.1625000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Si
data:
SILICON
S   6
  1  69379.2300000              0.0007570        
  2  10354.9400000              0.0059320        
  3   2333.8796000              0.0310880        
  4    657.1429500              0.1249670        
  5    214.3011300              0.3868970        
  6     77.6291680              0.5548880        
S   3
  1     77.6291680              0.1778810        
  2     30.6308070              0.6277650        
  3     12.8012950              0.2476230        
S   1
  1      3.9268660              1.0000000        
S   1
  1      1.4523430              1.0000000        
S   1
  1      0.2562340              1.0000000        
S   1
  1      0.0942790              1.0000000        
P   4
  1    335.4831900              0.0088660        
  2     78.9003660              0.0682990        
  3     24.9881500              0.2909580        
  4      9.2197110              0.7321170        
P   2
  1      3.6211400              0.6198790        
  2      1.4513100              0.4391480        
P   1
  1      0.5049770              1.0000000        
P   1
  1      0.1863170              1.0000000        
P   1
  1      0.0654320              1.0000000        
L   1
  1      0.0331000              1.0000000              1.0000000        
D   1
  1      0.9000000              1.0000000        
D   1
  1      0.2250000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   6
  1  77492.4000000              0.0007810        
  2  11605.8000000              0.0060680        
  3   2645.9600000              0.0311600        
  4    754.9760000              0.1234310        
  5    248.7550000              0.3782090        
  6     91.1565000              0.5632620        
S   3
  1     91.1565000              0.1602550        
  2     36.2257000              0.6276470        
  3     15.2113000              0.2638490        
S   1
  1      4.7941700              1.0000000        
S   1
  1      1.8079300              1.0000000        
S   1
  1      0.3568160              1.0000000        
S   1
  1      0.1147830              1.0000000        
P   4
  1    384.8430000              0.0092060        
  2     90.5521000              0.0698740        
  3     29.1339000              0.2924700        
  4     10.8862000              0.7281030        
P   2
  1      4.3525900              0.6283490        
  2      1.7770600              0.4280440        
P   1
  1      0.6970050              1.0000000        
P   1
  1      0.2535320              1.0000000        
P   1
  1      0.0684930              1.0000000        
L   1
  1      0.0348000              1.0000000              1.0000000        
D   1
  1      1.1000000              1.0000000        
D   1
  1      0.2750000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: S
data:
SULFUR
S   6
  1  93413.4000000              0.0007430        
  2  13961.7000000              0.0057930        
  3   3169.9100000              0.0299540        
  4    902.4560000              0.1190280        
  5    297.1580000              0.3684320        
  6    108.7020000              0.5772990        
S   3
  1    108.7020000              0.1431860        
  2     43.1553000              0.6244650        
  3     18.1079000              0.2833660        
S   1
  1      5.5600900              1.0000000        
S   1
  1      2.1318300              1.0000000        
S   1
  1      0.4204030              1.0000000        
S   1
  1      0.1360450              1.0000000        
P   4
  1    495.0400000              0.0083090        
  2    117.2210000              0.0640240        
  3     37.7749000              0.2776140        
  4     14.0584000              0.7450760        
P   2
  1      5.5657400              0.6137120        
  2      2.2629700              0.4438180        
P   1
  1      0.8079940              1.0000000        
P   1
  1      0.2774600              1.0000000        
P   1
  1      0.0771410              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.3250000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   6
  1 105819.0000000              0.0007380        
  2  15872.0000000              0.0057180        
  3   3619.6500000              0.0294950        
  4   1030.8000000              0.1172860        
  5    339.9080000              0.3629490        
  6    124.5380000              0.5841490        
S   3
  1    124.5380000              0.1341770        
  2     49.5135000              0.6242500        
  3     20.8056000              0.2917560        
S   1
  1      6.5834600              1.0000000        
S   1
  1      2.5646800              1.0000000        
S   1
  1      0.5597630              1.0000000        
S   1
  1      0.1832730              1.0000000        
P   5
  1    589.7760000              0.0023910        
  2    139.8490000              0.0185040        
  3     45.1413000              0.0813770        
  4     16.8733000              0.2215520        
  5      6.7411000              0.7725690        
P   2
  1      6.7411000             -1.5722440        
  2      2.7715200              0.9923890        
P   1
  1      1.0238700              1.0000000        
P   1
  1      0.3813680              1.0000000        
P   1
  1      0.1094370              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      1.5000000              1.0000000        
D   1
  1      0.3750000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Ar
data:
ARGON
S   6
  1 118022.3800000              0.0007470        
  2  17683.5410000              0.0057900        
  3   4027.7657000              0.0299190        
  4   1145.3977000              0.1192060        
  5    377.1637500              0.3690280        
  6    138.1596900              0.5764590        
S   3
  1    138.1596900              0.1439270        
  2     54.9891170              0.6229380        
  3     23.1706670              0.2839640        
S   1
  1      7.3778600              1.0000000        
S   1
  1      2.9236880              1.0000000        
S   1
  1      0.6504050              1.0000000        
S   1
  1      0.2328250              1.0000000        
P   5
  1    663.0620100              0.0030820        
  2    157.0928100              0.0241650        
  3     50.2311000              0.1082230        
  4     18.6353450              0.2941920        
  5      7.4465370              0.6878620        
P   2
  1      7.4465370             -0.1214482        
  2      3.0956980              0.1632370        
P   1
  1      1.1064630              1.0000000        
P   1
  1      0.4156010              1.0000000        
P   1
  1      0.1454490              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000        
D   1
  1      1.7000000              1.0000000        
D   1
  1      0.4250000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: K
data:
POTASSIUM
S   6
  1 182594.0000000              0.000227747      
  2  27369.0000000              0.00176640       
  3   6229.1700000              0.00919497       
  4   1764.5800000              0.03745510       
  5    577.0510000              0.12204500       
  6    210.2490000              0.29899000       
S   2
  1     82.6178000              0.4051470        
  2     33.2332000              0.2925320        
S   1
  1      8.1064900              1.0000000        
S   1
  1      3.3340300              1.0000000        
S   1
  1      0.8455440              1.0000000        
S   1
  1      0.3282160              1.0000000        
S   1
  1      0.0364035              1.0000000        
S   1
  1      0.0176463              1.0000000        
P   3
  1    891.0540000              0.00218429       
  2    211.0160000              0.0175891        
  3     67.6714000              0.0817775        
P   3
  1     25.2715000              0.2456560        
  2     10.1390000              0.4339840        
  3      4.2018600              0.3623770        
P   1
  1      1.6250700              1.0000000        
P   1
  1      0.6437700              1.0000000        
P   1
  1      0.2461300              1.0000000        
P   1
  1      0.0454400              1.0000000        
P   1
  1      0.0161600              1.0000000        
L   1
  1      0.0047000              1.0000000              1.0000000        
D   3
  1     13.3700000              0.0316016        
  2      3.4210000              0.1568790        
  3      1.0630000              0.3905820        
D   1
  1      0.4580000              1.0000000        
D   1
  1      0.1145000              1.0000000


name: 6-311++G(2d,2p)
description: VTZ2PD Valence Triple Zeta + Double Polar. + Diffuse on All Atoms
elt: Ca
data:
CALCIUM
S   6
  1 202699.0000000              0.000222964      
  2  30382.5000000              0.00172932       
  3   6915.0800000              0.00900226       
  4   1959.0200000              0.0366699        
  5    640.9360000              0.1194100        
  6    233.9770000              0.2918250        
S   2
  1     92.2892000              0.4044150        
  2     37.2545000              0.2963130        
S   1
  1      9.1319800              1.0000000        
S   1
  1      3.8177900              1.0000000        
S   1
  1      1.0493500              1.0000000        
S   1
  1      0.4286600              1.0000000        
S   1
  1      0.0628226              1.0000000        
S   1
  1      0.0260162              1.0000000        
P   3
  1   1019.7600000              0.00205986       
  2    241.5960000              0.01665010       
  3     77.6370000              0.07776460       
P   3
  1     29.1154000              0.2418060        
  2     11.7626000              0.4325780        
  3      4.9228900              0.3673250        
P   1
  1      1.9064500              1.0000000        
P   1
  1      0.7369000              1.0000000        
P   1
  1      0.2764200              1.0000000        
P   1
  1      0.0602700              1.0000000        
P   1
  1      0.0179100              1.0000000        
L   1
  1      0.0071000              1.0000000              1.0000000        
D   3
  1     15.0800000              0.0368947        
  2      3.9260000              0.1778200        
  3      1.2330000              0.4255130        
D   1
  1      0.5200000              1.0000000        
D   1
  1      0.1300000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: H
data:
HYDROGEN
S   3
  1     33.8650000              0.0254938        
  2      5.0947900              0.1903730        
  3      1.1587900              0.8521610        
S   1
  1      0.3258400              1.0000000        
S   1
  1      0.1027410              1.0000000        
S   1
  1      0.0360000              1.0000000        
P   1
  1      3.0000000              1.0000000        
P   1
  1      0.7500000              1.0000000        
P   1
  1      0.1875000              1.0000000        
D   1
  1      1.0000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   6
  1    900.4600000              0.00228704       
  2    134.4330000              0.0176350        
  3     30.4365000              0.0873434        
  4      8.6263900              0.2809770        
  5      2.4833200              0.6587410        
  6      0.3031790              0.1187120        
L   3
  1      4.8689000              0.0933293              0.0327661        
  2      0.8569240              0.9430450              0.1597920        
  3      0.2432270             -0.00279827             0.8856670        
L   1
  1      0.0635070              1.0000000              1.0000000        
L   1
  1      0.0243683              1.0000000              1.0000000        
L   1
  1      0.0074000              1.0000000              1.0000000        
D   1
  1      0.8000000              1.0000000        
D   1
  1      0.2000000              1.0000000        
D   1
  1      0.0500000              1.0000000        
F   1
  1      0.1500000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   6
  1   1682.8000000              0.00228574       
  2    251.7150000              0.0175938        
  3     57.4116000              0.0863315        
  4     16.5171000              0.2818350        
  5      4.8536400              0.6405940        
  6      0.6268630              0.1444670        
L   3
  1      8.3093800              0.1086210              0.0361344        
  2      1.7407500              0.9273010              0.2169580        
  3      0.4858160             -0.00297169             0.8418390        
L   1
  1      0.1636130              1.0000000              1.0000000        
L   1
  1      0.0567285              1.0000000              1.0000000        
L   1
  1      0.0207000              1.0000000              1.0000000        
D   1
  1      1.0200000              1.0000000        
D   1
  1      0.2550000              1.0000000        
D   1
  1      0.0637500              1.0000000        
F   1
  1      0.2600000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: B
data:
BORON
S   6
  1   2858.8900000              0.00215375       
  2    428.1400000              0.0165823        
  3     97.5282000              0.0821870        
  4     27.9693000              0.2766180        
  5      8.2157700              0.6293160        
  6      1.1127800              0.1737700        
L   3
  1     13.2415000              0.1174430              0.0418100        
  2      3.0016600              0.9180020              0.2365750        
  3      0.9128560             -0.00265105             0.8162140        
L   1
  1      0.3154540              1.0000000              1.0000000        
L   1
  1      0.0988563              1.0000000              1.0000000        
L   1
  1      0.0315000              1.0000000              1.0000000        
D   1
  1      1.6040000              1.0000000        
D   1
  1      0.4010000              1.0000000        
D   1
  1      0.1002500              1.0000000        
F   1
  1      0.5000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: C
data:
CARBON
S   6
  1   4563.2400000              0.00196665       
  2    682.0240000              0.0152306        
  3    154.9730000              0.0761269        
  4     44.4553000              0.2608010        
  5     13.0290000              0.6164620        
  6      1.8277300              0.2210060        
L   3
  1     20.9642000              0.1146600              0.0402487        
  2      4.8033100              0.9199990              0.2375940        
  3      1.4593300             -0.00303068             0.8158540        
L   1
  1      0.4834560              1.0000000              1.0000000        
L   1
  1      0.1455850              1.0000000              1.0000000        
L   1
  1      0.0438000              1.0000000              1.0000000        
D   1
  1      2.5040000              1.0000000        
D   1
  1      0.6260000              1.0000000        
D   1
  1      0.1565000              1.0000000        
F   1
  1      0.8000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: N
data:
NITROGEN
S   6
  1   6293.4800000              0.00196979       
  2    949.0440000              0.0149613        
  3    218.7760000              0.0735006        
  4     63.6916000              0.2489370        
  5     18.8282000              0.6024600        
  6      2.7202300              0.2562020        
L   3
  1     30.6331000              0.1119060              0.0383119        
  2      7.0261400              0.9216660              0.2374030        
  3      2.1120500             -0.00256919             0.8175920        
L   1
  1      0.6840090              1.0000000              1.0000000        
L   1
  1      0.2008780              1.0000000              1.0000000        
L   1
  1      0.0639000              1.0000000              1.0000000        
D   1
  1      3.6520000              1.0000000        
D   1
  1      0.9130000              1.0000000        
D   1
  1      0.2282500              1.0000000        
F   1
  1      1.0000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: O
data:
OXYGEN
S   6
  1   8588.5000000              0.00189515       
  2   1297.2300000              0.0143859        
  3    299.2960000              0.0707320        
  4     87.3771000              0.2400010        
  5     25.6789000              0.5947970        
  6      3.7400400              0.2808020        
L   3
  1     42.1175000              0.1138890              0.0365114        
  2      9.6283700              0.9208110              0.2371530        
  3      2.8533200             -0.00327447             0.8197020        
L   1
  1      0.9056610              1.0000000              1.0000000        
L   1
  1      0.2556110              1.0000000              1.0000000        
L   1
  1      0.0845000              1.0000000              1.0000000        
D   1
  1      5.1600000              1.0000000        
D   1
  1      1.2920000              1.0000000        
D   1
  1      0.3225000              1.0000000        
F   1
  1      1.4000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: F
data:
FLUORINE
S   6
  1  11427.1000000              0.00180093       
  2   1722.3500000              0.0137419        
  3    395.7460000              0.0681334        
  4    115.1390000              0.2333250        
  5     33.6026000              0.5890860        
  6      4.9190100              0.2995050        
L   3
  1     55.4441000              0.1145360              0.0354609        
  2     12.6323000              0.9205120              0.2374510        
  3      3.7175600             -0.00337804             0.8204580        
L   1
  1      1.1654500              1.0000000              1.0000000        
L   1
  1      0.3218920              1.0000000              1.0000000        
L   1
  1      0.1076000              1.0000000              1.0000000        
D   1
  1      7.0000000              1.0000000        
D   1
  1      1.7500000              1.0000000        
D   1
  1      0.4375000              1.0000000        
F   1
  1      1.8500000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Ne
data:
NEON
S   6
  1  13995.7000000              0.00183276       
  2   2117.1000000              0.0138827        
  3    490.4250000              0.0680687        
  4    143.8330000              0.2313280        
  5     41.9265000              0.5858900        
  6      6.1568400              0.3058830        
L   3
  1     69.1211000              0.1191490              0.0356574        
  2     15.8350000              0.9173750              0.2394770        
  3      4.6732600             -0.00405839             0.8184610        
L   1
  1      1.4575600              1.0000000              1.0000000        
L   1
  1      0.3970570              1.0000000              1.0000000        
L   1
  1      0.1300000              1.0000000              1.0000000        
D   1
  1      9.2160000              1.0000000        
D   1
  1      2.3040000              1.0000000        
D   1
  1      0.5760000              1.0000000        
F   1
  1      2.5000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Na
data:
SODIUM
S   6
  1  36166.4000000              0.0010320        
  2   5372.5800000              0.0080710        
  3   1213.2100000              0.0421290        
  4    339.6230000              0.1697890        
  5    109.5530000              0.5146210        
  6     38.7773000              0.3798170        
S   3
  1     38.7773000              0.3747620        
  2     14.5759000              0.5757690        
  3      5.2699300              0.1129330        
S   1
  1      1.8277700              1.0000000        
S   1
  1      0.6199480              1.0000000        
S   1
  1      0.0572400              1.0000000        
S   1
  1      0.0240480              1.0000000        
P   4
  1    144.6450000              0.0114850        
  2     33.9074000              0.0823830        
  3     10.6285000              0.3196580        
  4      3.8238900              0.7012950        
P   2
  1      1.4442900              0.6385060        
  2      0.5526210              0.4253650        
P   1
  1      0.1887200              1.0000000        
P   1
  1      0.0465010              1.0000000        
P   1
  1      0.0162850              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000        
D   1
  1      0.7000000              1.0000000        
D   1
  1      0.1750000              1.0000000        
D   1
  1      0.0437500              1.0000000        
F   1
  1      0.1500000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   6
  1  43866.5000000              0.0009180        
  2   6605.3700000              0.0070470        
  3   1513.2600000              0.0359410        
  4    432.3170000              0.1414610        
  5    142.1490000              0.4267640        
  6     51.3983000              0.4979750        
S   3
  1     51.3983000              0.2513550        
  2     19.9196000              0.6186710        
  3      8.0247400              0.1884170        
S   1
  1      2.5081700              1.0000000        
S   1
  1      0.8715310              1.0000000        
S   1
  1      0.1081880              1.0000000        
S   1
  1      0.0401300              1.0000000        
P   4
  1    193.8540000              0.0101880        
  2     45.4420000              0.0753600        
  3     14.1864000              0.3074190        
  4      5.0575100              0.7175750        
P   2
  1      1.8886100              0.6673390        
  2      0.7226520              0.3946490        
P   1
  1      0.2364170              1.0000000        
P   1
  1      0.0933580              1.0000000        
P   1
  1      0.0348090              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000        
D   1
  1      0.7000000              1.0000000        
D   1
  1      0.1750000              1.0000000        
D   1
  1      0.0437500              1.0000000        
F   1
  1      0.2000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   6
  1  54866.4890000              0.0008390        
  2   8211.7665000              0.0065270        
  3   1866.1761000              0.0336660        
  4    531.1293400              0.1329020        
  5    175.1179700              0.4012660        
  6     64.0055000              0.5313380        
S   3
  1     64.0055000              0.2023050        
  2     25.2925070              0.6247900        
  3     10.5349100              0.2274390        
S   1
  1      3.2067110              1.0000000        
S   1
  1      1.1525550              1.0000000        
S   1
  1      0.1766780              1.0000000        
S   1
  1      0.0652370              1.0000000        
P   4
  1    259.2836200              0.0094480        
  2     61.0768700              0.0709740        
  3     19.3032370              0.2956360        
  4      7.0108820              0.7282190        
P   2
  1      2.6738650              0.6444670        
  2      1.0365960              0.4174130        
P   1
  1      0.3168190              1.0000000        
P   1
  1      0.1142570              1.0000000        
P   1
  1      0.0413970              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000        
D   1
  1      1.3000000              1.0000000        
D   1
  1      0.3250000              1.0000000        
D   1
  1      0.0812500              1.0000000        
F   1
  1      0.2500000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Si
data:
SILICON
S   6
  1  69379.2300000              0.0007570        
  2  10354.9400000              0.0059320        
  3   2333.8796000              0.0310880        
  4    657.1429500              0.1249670        
  5    214.3011300              0.3868970        
  6     77.6291680              0.5548880        
S   3
  1     77.6291680              0.1778810        
  2     30.6308070              0.6277650        
  3     12.8012950              0.2476230        
S   1
  1      3.9268660              1.0000000        
S   1
  1      1.4523430              1.0000000        
S   1
  1      0.2562340              1.0000000        
S   1
  1      0.0942790              1.0000000        
P   4
  1    335.4831900              0.0088660        
  2     78.9003660              0.0682990        
  3     24.9881500              0.2909580        
  4      9.2197110              0.7321170        
P   2
  1      3.6211400              0.6198790        
  2      1.4513100              0.4391480        
P   1
  1      0.5049770              1.0000000        
P   1
  1      0.1863170              1.0000000        
P   1
  1      0.0654320              1.0000000        
L   1
  1      0.0331000              1.0000000              1.0000000        
D   1
  1      1.8000000              1.0000000        
D   1
  1      0.4500000              1.0000000        
D   1
  1      0.1125000              1.0000000        
F   1
  1      0.3200000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   6
  1  77492.4000000              0.0007810        
  2  11605.8000000              0.0060680        
  3   2645.9600000              0.0311600        
  4    754.9760000              0.1234310        
  5    248.7550000              0.3782090        
  6     91.1565000              0.5632620        
S   3
  1     91.1565000              0.1602550        
  2     36.2257000              0.6276470        
  3     15.2113000              0.2638490        
S   1
  1      4.7941700              1.0000000        
S   1
  1      1.8079300              1.0000000        
S   1
  1      0.3568160              1.0000000        
S   1
  1      0.1147830              1.0000000        
P   4
  1    384.8430000              0.0092060        
  2     90.5521000              0.0698740        
  3     29.1339000              0.2924700        
  4     10.8862000              0.7281030        
P   2
  1      4.3525900              0.6283490        
  2      1.7770600              0.4280440        
P   1
  1      0.6970050              1.0000000        
P   1
  1      0.2535320              1.0000000        
P   1
  1      0.0684930              1.0000000        
L   1
  1      0.0348000              1.0000000              1.0000000        
D   1
  1      2.2000000              1.0000000        
D   1
  1      0.5500000              1.0000000        
D   1
  1      0.1375000              1.0000000        
F   1
  1      0.4500000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: S
data:
SULFUR
S   6
  1  93413.4000000              0.0007430        
  2  13961.7000000              0.0057930        
  3   3169.9100000              0.0299540        
  4    902.4560000              0.1190280        
  5    297.1580000              0.3684320        
  6    108.7020000              0.5772990        
S   3
  1    108.7020000              0.1431860        
  2     43.1553000              0.6244650        
  3     18.1079000              0.2833660        
S   1
  1      5.5600900              1.0000000        
S   1
  1      2.1318300              1.0000000        
S   1
  1      0.4204030              1.0000000        
S   1
  1      0.1360450              1.0000000        
P   4
  1    495.0400000              0.0083090        
  2    117.2210000              0.0640240        
  3     37.7749000              0.2776140        
  4     14.0584000              0.7450760        
P   2
  1      5.5657400              0.6137120        
  2      2.2629700              0.4438180        
P   1
  1      0.8079940              1.0000000        
P   1
  1      0.2774600              1.0000000        
P   1
  1      0.0771410              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      2.6000000              1.0000000        
D   1
  1      0.6500000              1.0000000        
D   1
  1      0.1625000              1.0000000        
F   1
  1      0.5500000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   6
  1 105819.0000000              0.0007380        
  2  15872.0000000              0.0057180        
  3   3619.6500000              0.0294950        
  4   1030.8000000              0.1172860        
  5    339.9080000              0.3629490        
  6    124.5380000              0.5841490        
S   3
  1    124.5380000              0.1341770        
  2     49.5135000              0.6242500        
  3     20.8056000              0.2917560        
S   1
  1      6.5834600              1.0000000        
S   1
  1      2.5646800              1.0000000        
S   1
  1      0.5597630              1.0000000        
S   1
  1      0.1832730              1.0000000        
P   5
  1    589.7760000              0.0023910        
  2    139.8490000              0.0185040        
  3     45.1413000              0.0813770        
  4     16.8733000              0.2215520        
  5      6.7411000              0.7725690        
P   2
  1      6.7411000             -1.5722440        
  2      2.7715200              0.9923890        
P   1
  1      1.0238700              1.0000000        
P   1
  1      0.3813680              1.0000000        
P   1
  1      0.1094370              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      3.0000000              1.0000000        
D   1
  1      0.7500000              1.0000000        
D   1
  1      0.1875000              1.0000000        
F   1
  1      0.7000000              1.0000000


name: 6-311++G(3df,3pd)
description: VTZ3PD Valence Triple Zeta + Triple Polar. + Diffuse on All Atoms
elt: Ar
data:
ARGON
S   6
  1 118022.3800000              0.0007470        
  2  17683.5410000              0.0057900        
  3   4027.7657000              0.0299190        
  4   1145.3977000              0.1192060        
  5    377.1637500              0.3690280        
  6    138.1596900              0.5764590        
S   3
  1    138.1596900              0.1439270        
  2     54.9891170              0.6229380        
  3     23.1706670              0.2839640        
S   1
  1      7.3778600              1.0000000        
S   1
  1      2.9236880              1.0000000        
S   1
  1      0.6504050              1.0000000        
S   1
  1      0.2328250              1.0000000        
P   5
  1    663.0620100              0.0030820        
  2    157.0928100              0.0241650        
  3     50.2311000              0.1082230        
  4     18.6353450              0.2941920        
  5      7.4465370              0.6878620        
P   2
  1      7.4465370             -0.1214482        
  2      3.0956980              0.1632370        
P   1
  1      1.1064630              1.0000000        
P   1
  1      0.4156010              1.0000000        
P   1
  1      0.1454490              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000        
D   1
  1      3.4000000              1.0000000        
D   1
  1      0.8500000              1.0000000        
D   1
  1      0.2125000              1.0000000        
F   1
  1      0.8500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: H
data:
HYDROGEN
S   3
  1     33.8650000              0.0254938        
  2      5.0947900              0.1903730        
  3      1.1587900              0.8521610        
S   1
  1      0.3258400              1.0000000        
S   1
  1      0.1027410              1.0000000        
S   1
  1      0.0360000              1.0000000        
P   1
  1      0.7500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Li
data:
LITHIUM
S   6
  1    900.4600000              0.00228704       
  2    134.4330000              0.0176350        
  3     30.4365000              0.0873434        
  4      8.6263900              0.2809770        
  5      2.4833200              0.6587410        
  6      0.3031790              0.1187120        
L   3
  1      4.8689000              0.0933293              0.0327661        
  2      0.8569240              0.9430450              0.1597920        
  3      0.2432270             -0.00279827             0.8856670        
L   1
  1      0.0635070              1.0000000              1.0000000        
L   1
  1      0.0243683              1.0000000              1.0000000        
L   1
  1      0.0074000              1.0000000              1.0000000        
D   1
  1      0.2000000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Be
data:
BERYLLIUM
S   6
  1   1682.8000000              0.00228574       
  2    251.7150000              0.0175938        
  3     57.4116000              0.0863315        
  4     16.5171000              0.2818350        
  5      4.8536400              0.6405940        
  6      0.6268630              0.1444670        
L   3
  1      8.3093800              0.1086210              0.0361344        
  2      1.7407500              0.9273010              0.2169580        
  3      0.4858160             -0.00297169             0.8418390        
L   1
  1      0.1636130              1.0000000              1.0000000        
L   1
  1      0.0567285              1.0000000              1.0000000        
L   1
  1      0.0207000              1.0000000              1.0000000        
D   1
  1      0.2550000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: B
data:
BORON
S   6
  1   2858.8900000              0.00215375       
  2    428.1400000              0.0165823        
  3     97.5282000              0.0821870        
  4     27.9693000              0.2766180        
  5      8.2157700              0.6293160        
  6      1.1127800              0.1737700        
L   3
  1     13.2415000              0.1174430              0.0418100        
  2      3.0016600              0.9180020              0.2365750        
  3      0.9128560             -0.00265105             0.8162140        
L   1
  1      0.3154540              1.0000000              1.0000000        
L   1
  1      0.0988563              1.0000000              1.0000000        
L   1
  1      0.0315000              1.0000000              1.0000000        
D   1
  1      0.4010000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: C
data:
CARBON
S   6
  1   4563.2400000              0.00196665       
  2    682.0240000              0.0152306        
  3    154.9730000              0.0761269        
  4     44.4553000              0.2608010        
  5     13.0290000              0.6164620        
  6      1.8277300              0.2210060        
L   3
  1     20.9642000              0.1146600              0.0402487        
  2      4.8033100              0.9199990              0.2375940        
  3      1.4593300             -0.00303068             0.8158540        
L   1
  1      0.4834560              1.0000000              1.0000000        
L   1
  1      0.1455850              1.0000000              1.0000000        
L   1
  1      0.0438000              1.0000000              1.0000000        
D   1
  1      0.6260000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: N
data:
NITROGEN
S   6
  1   6293.4800000              0.00196979       
  2    949.0440000              0.0149613        
  3    218.7760000              0.0735006        
  4     63.6916000              0.2489370        
  5     18.8282000              0.6024600        
  6      2.7202300              0.2562020        
L   3
  1     30.6331000              0.1119060              0.0383119        
  2      7.0261400              0.9216660              0.2374030        
  3      2.1120500             -0.00256919             0.8175920        
L   1
  1      0.6840090              1.0000000              1.0000000        
L   1
  1      0.2008780              1.0000000              1.0000000        
L   1
  1      0.0639000              1.0000000              1.0000000        
D   1
  1      0.9130000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: O
data:
OXYGEN
S   6
  1   8588.5000000              0.00189515       
  2   1297.2300000              0.0143859        
  3    299.2960000              0.0707320        
  4     87.3771000              0.2400010        
  5     25.6789000              0.5947970        
  6      3.7400400              0.2808020        
L   3
  1     42.1175000              0.1138890              0.0365114        
  2      9.6283700              0.9208110              0.2371530        
  3      2.8533200             -0.00327447             0.8197020        
L   1
  1      0.9056610              1.0000000              1.0000000        
L   1
  1      0.2556110              1.0000000              1.0000000        
L   1
  1      0.0845000              1.0000000              1.0000000        
D   1
  1      1.2920000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: F
data:
FLUORINE
S   6
  1  11427.1000000              0.00180093       
  2   1722.3500000              0.0137419        
  3    395.7460000              0.0681334        
  4    115.1390000              0.2333250        
  5     33.6026000              0.5890860        
  6      4.9190100              0.2995050        
L   3
  1     55.4441000              0.1145360              0.0354609        
  2     12.6323000              0.9205120              0.2374510        
  3      3.7175600             -0.00337804             0.8204580        
L   1
  1      1.1654500              1.0000000              1.0000000        
L   1
  1      0.3218920              1.0000000              1.0000000        
L   1
  1      0.1076000              1.0000000              1.0000000        
D   1
  1      1.7500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Ne
data:
NEON
S   6
  1  13995.7000000              0.00183276       
  2   2117.1000000              0.0138827        
  3    490.4250000              0.0680687        
  4    143.8330000              0.2313280        
  5     41.9265000              0.5858900        
  6      6.1568400              0.3058830        
L   3
  1     69.1211000              0.1191490              0.0356574        
  2     15.8350000              0.9173750              0.2394770        
  3      4.6732600             -0.00405839             0.8184610        
L   1
  1      1.4575600              1.0000000              1.0000000        
L   1
  1      0.3970570              1.0000000              1.0000000        
L   1
  1      0.1300000              1.0000000              1.0000000        
D   1
  1      2.3040000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Na
data:
SODIUM
S   6
  1  36166.4000000              0.0010320        
  2   5372.5800000              0.0080710        
  3   1213.2100000              0.0421290        
  4    339.6230000              0.1697890        
  5    109.5530000              0.5146210        
  6     38.7773000              0.3798170        
S   3
  1     38.7773000              0.3747620        
  2     14.5759000              0.5757690        
  3      5.2699300              0.1129330        
S   1
  1      1.8277700              1.0000000        
S   1
  1      0.6199480              1.0000000        
S   1
  1      0.0572400              1.0000000        
S   1
  1      0.0240480              1.0000000        
P   4
  1    144.6450000              0.0114850        
  2     33.9074000              0.0823830        
  3     10.6285000              0.3196580        
  4      3.8238900              0.7012950        
P   2
  1      1.4442900              0.6385060        
  2      0.5526210              0.4253650        
P   1
  1      0.1887200              1.0000000        
P   1
  1      0.0465010              1.0000000        
P   1
  1      0.0162850              1.0000000        
L   1
  1      0.0076000              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Mg
data:
MAGNESIUM
S   6
  1  43866.5000000              0.0009180        
  2   6605.3700000              0.0070470        
  3   1513.2600000              0.0359410        
  4    432.3170000              0.1414610        
  5    142.1490000              0.4267640        
  6     51.3983000              0.4979750        
S   3
  1     51.3983000              0.2513550        
  2     19.9196000              0.6186710        
  3      8.0247400              0.1884170        
S   1
  1      2.5081700              1.0000000        
S   1
  1      0.8715310              1.0000000        
S   1
  1      0.1081880              1.0000000        
S   1
  1      0.0401300              1.0000000        
P   4
  1    193.8540000              0.0101880        
  2     45.4420000              0.0753600        
  3     14.1864000              0.3074190        
  4      5.0575100              0.7175750        
P   2
  1      1.8886100              0.6673390        
  2      0.7226520              0.3946490        
P   1
  1      0.2364170              1.0000000        
P   1
  1      0.0933580              1.0000000        
P   1
  1      0.0348090              1.0000000        
L   1
  1      0.0146000              1.0000000              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Al
data:
ALUMINUM
S   6
  1  54866.4890000              0.0008390        
  2   8211.7665000              0.0065270        
  3   1866.1761000              0.0336660        
  4    531.1293400              0.1329020        
  5    175.1179700              0.4012660        
  6     64.0055000              0.5313380        
S   3
  1     64.0055000              0.2023050        
  2     25.2925070              0.6247900        
  3     10.5349100              0.2274390        
S   1
  1      3.2067110              1.0000000        
S   1
  1      1.1525550              1.0000000        
S   1
  1      0.1766780              1.0000000        
S   1
  1      0.0652370              1.0000000        
P   4
  1    259.2836200              0.0094480        
  2     61.0768700              0.0709740        
  3     19.3032370              0.2956360        
  4      7.0108820              0.7282190        
P   2
  1      2.6738650              0.6444670        
  2      1.0365960              0.4174130        
P   1
  1      0.3168190              1.0000000        
P   1
  1      0.1142570              1.0000000        
P   1
  1      0.0413970              1.0000000        
L   1
  1      0.0318000              1.0000000              1.0000000        
D   1
  1      0.3250000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Si
data:
SILICON
S   6
  1  69379.2300000              0.0007570        
  2  10354.9400000              0.0059320        
  3   2333.8796000              0.0310880        
  4    657.1429500              0.1249670        
  5    214.3011300              0.3868970        
  6     77.6291680              0.5548880        
S   3
  1     77.6291680              0.1778810        
  2     30.6308070              0.6277650        
  3     12.8012950              0.2476230        
S   1
  1      3.9268660              1.0000000        
S   1
  1      1.4523430              1.0000000        
S   1
  1      0.2562340              1.0000000        
S   1
  1      0.0942790              1.0000000        
P   4
  1    335.4831900              0.0088660        
  2     78.9003660              0.0682990        
  3     24.9881500              0.2909580        
  4      9.2197110              0.7321170        
P   2
  1      3.6211400              0.6198790        
  2      1.4513100              0.4391480        
P   1
  1      0.5049770              1.0000000        
P   1
  1      0.1863170              1.0000000        
P   1
  1      0.0654320              1.0000000        
L   1
  1      0.0331000              1.0000000              1.0000000        
D   1
  1      0.4500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: P
data:
PHOSPHORUS
S   6
  1  77492.4000000              0.0007810        
  2  11605.8000000              0.0060680        
  3   2645.9600000              0.0311600        
  4    754.9760000              0.1234310        
  5    248.7550000              0.3782090        
  6     91.1565000              0.5632620        
S   3
  1     91.1565000              0.1602550        
  2     36.2257000              0.6276470        
  3     15.2113000              0.2638490        
S   1
  1      4.7941700              1.0000000        
S   1
  1      1.8079300              1.0000000        
S   1
  1      0.3568160              1.0000000        
S   1
  1      0.1147830              1.0000000        
P   4
  1    384.8430000              0.0092060        
  2     90.5521000              0.0698740        
  3     29.1339000              0.2924700        
  4     10.8862000              0.7281030        
P   2
  1      4.3525900              0.6283490        
  2      1.7770600              0.4280440        
P   1
  1      0.6970050              1.0000000        
P   1
  1      0.2535320              1.0000000        
P   1
  1      0.0684930              1.0000000        
L   1
  1      0.0348000              1.0000000              1.0000000        
D   1
  1      0.5500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: S
data:
SULFUR
S   6
  1  93413.4000000              0.0007430        
  2  13961.7000000              0.0057930        
  3   3169.9100000              0.0299540        
  4    902.4560000              0.1190280        
  5    297.1580000              0.3684320        
  6    108.7020000              0.5772990        
S   3
  1    108.7020000              0.1431860        
  2     43.1553000              0.6244650        
  3     18.1079000              0.2833660        
S   1
  1      5.5600900              1.0000000        
S   1
  1      2.1318300              1.0000000        
S   1
  1      0.4204030              1.0000000        
S   1
  1      0.1360450              1.0000000        
P   4
  1    495.0400000              0.0083090        
  2    117.2210000              0.0640240        
  3     37.7749000              0.2776140        
  4     14.0584000              0.7450760        
P   2
  1      5.5657400              0.6137120        
  2      2.2629700              0.4438180        
P   1
  1      0.8079940              1.0000000        
P   1
  1      0.2774600              1.0000000        
P   1
  1      0.0771410              1.0000000        
L   1
  1      0.0405000              1.0000000              1.0000000        
D   1
  1      0.6500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Cl
data:
CHLORINE
S   6
  1 105819.0000000              0.0007380        
  2  15872.0000000              0.0057180        
  3   3619.6500000              0.0294950        
  4   1030.8000000              0.1172860        
  5    339.9080000              0.3629490        
  6    124.5380000              0.5841490        
S   3
  1    124.5380000              0.1341770        
  2     49.5135000              0.6242500        
  3     20.8056000              0.2917560        
S   1
  1      6.5834600              1.0000000        
S   1
  1      2.5646800              1.0000000        
S   1
  1      0.5597630              1.0000000        
S   1
  1      0.1832730              1.0000000        
P   5
  1    589.7760000              0.0023910        
  2    139.8490000              0.0185040        
  3     45.1413000              0.0813770        
  4     16.8733000              0.2215520        
  5      6.7411000              0.7725690        
P   2
  1      6.7411000             -1.5722440        
  2      2.7715200              0.9923890        
P   1
  1      1.0238700              1.0000000        
P   1
  1      0.3813680              1.0000000        
P   1
  1      0.1094370              1.0000000        
L   1
  1      0.0483000              1.0000000              1.0000000        
D   1
  1      0.7500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Ar
data:
ARGON
S   6
  1 118022.3800000              0.0007470        
  2  17683.5410000              0.0057900        
  3   4027.7657000              0.0299190        
  4   1145.3977000              0.1192060        
  5    377.1637500              0.3690280        
  6    138.1596900              0.5764590        
S   3
  1    138.1596900              0.1439270        
  2     54.9891170              0.6229380        
  3     23.1706670              0.2839640        
S   1
  1      7.3778600              1.0000000        
S   1
  1      2.9236880              1.0000000        
S   1
  1      0.6504050              1.0000000        
S   1
  1      0.2328250              1.0000000        
P   5
  1    663.0620100              0.0030820        
  2    157.0928100              0.0241650        
  3     50.2311000              0.1082230        
  4     18.6353450              0.2941920        
  5      7.4465370              0.6878620        
P   2
  1      7.4465370             -0.1214482        
  2      3.0956980              0.1632370        
P   1
  1      1.1064630              1.0000000        
P   1
  1      0.4156010              1.0000000        
P   1
  1      0.1454490              1.0000000        
L   1
  1      0.0600000              1.0000000              1.0000000        
D   1
  1      0.8500000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: K
data:
POTASSIUM
S   6
  1 182594.0000000              0.000227747      
  2  27369.0000000              0.00176640       
  3   6229.1700000              0.00919497       
  4   1764.5800000              0.03745510       
  5    577.0510000              0.12204500       
  6    210.2490000              0.29899000       
S   2
  1     82.6178000              0.4051470        
  2     33.2332000              0.2925320        
S   1
  1      8.1064900              1.0000000        
S   1
  1      3.3340300              1.0000000        
S   1
  1      0.8455440              1.0000000        
S   1
  1      0.3282160              1.0000000        
S   1
  1      0.0364035              1.0000000        
S   1
  1      0.0176463              1.0000000        
P   3
  1    891.0540000              0.00218429       
  2    211.0160000              0.0175891        
  3     67.6714000              0.0817775        
P   3
  1     25.2715000              0.2456560        
  2     10.1390000              0.4339840        
  3      4.2018600              0.3623770        
P   1
  1      1.6250700              1.0000000        
P   1
  1      0.6437700              1.0000000        
P   1
  1      0.2461300              1.0000000        
P   1
  1      0.0454400              1.0000000        
P   1
  1      0.0161600              1.0000000        
L   1
  1      0.0047000              1.0000000              1.0000000        
D   3
  1     13.3700000              0.0316016        
  2      3.4210000              0.1568790        
  3      1.0630000              0.3905820        
D   1
  1      0.2290000              1.0000000


name: 6-311++G**
description: VTZPD Valence Triple Zeta + Polarization + Diffuse on All Atoms
elt: Ca
data:
CALCIUM
S   6
  1 202699.0000000              0.000222964      
  2  30382.5000000              0.00172932       
  3   6915.0800000              0.00900226       
  4   1959.0200000              0.0366699        
  5    640.9360000              0.1194100        
  6    233.9770000              0.2918250        
S   2
  1     92.2892000              0.4044150        
  2     37.2545000              0.2963130        
S   1
  1      9.1319800              1.0000000        
S   1
  1      3.8177900              1.0000000        
S   1
  1      1.0493500              1.0000000        
S   1
  1      0.4286600              1.0000000        
S   1
  1      0.0628226              1.0000000        
S   1
  1      0.0260162              1.0000000        
P   3
  1   1019.7600000              0.00205986       
  2    241.5960000              0.01665010       
  3     77.6370000              0.07776460       
P   3
  1     29.1154000              0.2418060        
  2     11.7626000              0.4325780        
  3      4.9228900              0.3673250        
P   1
  1      1.9064500              1.0000000        
P   1
  1      0.7369000              1.0000000        
P   1
  1      0.2764200              1.0000000        
P   1
  1      0.0602700              1.0000000        
P   1
  1      0.0179100              1.0000000        
L   1
  1      0.0071000              1.0000000              1.0000000        
D   3
  1     15.0800000              0.0368947        
  2      3.9260000              0.1778200        
  3      1.2330000              0.4255130        
D   1
  1      0.2600000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: H
data:
HYDROGEN
S   3
  1     33.8650000              0.0254938        
  2      5.0947900              0.1903730        
  3      1.1587900              0.8521610        
S   1
  1      0.3258400              1.0000000        
S   1
  1      0.1027410              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: He
data:
HELIUM
S   3
  1     98.1243000              0.0287452        
  2     14.7689000              0.2080610        
  3      3.3188300              0.8376350        
S   1
  1      0.8740470              1.0000000        
S   1
  1      0.2445640              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Li
data:
LITHIUM
S   6
  1    900.4600000              0.00228704       
  2    134.4330000              0.0176350        
  3     30.4365000              0.0873434        
  4      8.6263900              0.2809770        
  5      2.4833200              0.6587410        
  6      0.3031790              0.1187120        
L   3
  1      4.8689000              0.0933293              0.0327661        
  2      0.8569240              0.9430450              0.1597920        
  3      0.2432270             -0.00279827             0.8856670        
L   1
  1      0.0635070              1.0000000              1.0000000        
L   1
  1      0.0243683              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Be
data:
BERYLLIUM
S   6
  1   1682.8000000              0.00228574       
  2    251.7150000              0.0175938        
  3     57.4116000              0.0863315        
  4     16.5171000              0.2818350        
  5      4.8536400              0.6405940        
  6      0.6268630              0.1444670        
L   3
  1      8.3093800              0.1086210              0.0361344        
  2      1.7407500              0.9273010              0.2169580        
  3      0.4858160             -0.00297169             0.8418390        
L   1
  1      0.1636130              1.0000000              1.0000000        
L   1
  1      0.0567285              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: B
data:
BORON
S   6
  1   2858.8900000              0.00215375       
  2    428.1400000              0.0165823        
  3     97.5282000              0.0821870        
  4     27.9693000              0.2766180        
  5      8.2157700              0.6293160        
  6      1.1127800              0.1737700        
L   3
  1     13.2415000              0.1174430              0.0418100        
  2      3.0016600              0.9180020              0.2365750        
  3      0.9128560             -0.00265105             0.8162140        
L   1
  1      0.3154540              1.0000000              1.0000000        
L   1
  1      0.0988563              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: C
data:
CARBON
S   6
  1   4563.2400000              0.00196665       
  2    682.0240000              0.0152306        
  3    154.9730000              0.0761269        
  4     44.4553000              0.2608010        
  5     13.0290000              0.6164620        
  6      1.8277300              0.2210060        
L   3
  1     20.9642000              0.1146600              0.0402487        
  2      4.8033100              0.9199990              0.2375940        
  3      1.4593300             -0.00303068             0.8158540        
L   1
  1      0.4834560              1.0000000              1.0000000        
L   1
  1      0.1455850              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: N
data:
NITROGEN
S   6
  1   6293.4800000              0.00196979       
  2    949.0440000              0.0149613        
  3    218.7760000              0.0735006        
  4     63.6916000              0.2489370        
  5     18.8282000              0.6024600        
  6      2.7202300              0.2562020        
L   3
  1     30.6331000              0.1119060              0.0383119        
  2      7.0261400              0.9216660              0.2374030        
  3      2.1120500             -0.00256919             0.8175920        
L   1
  1      0.6840090              1.0000000              1.0000000        
L   1
  1      0.2008780              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: O
data:
OXYGEN
S   6
  1   8588.5000000              0.00189515       
  2   1297.2300000              0.0143859        
  3    299.2960000              0.0707320        
  4     87.3771000              0.2400010        
  5     25.6789000              0.5947970        
  6      3.7400400              0.2808020        
L   3
  1     42.1175000              0.1138890              0.0365114        
  2      9.6283700              0.9208110              0.2371530        
  3      2.8533200             -0.00327447             0.8197020        
L   1
  1      0.9056610              1.0000000              1.0000000        
L   1
  1      0.2556110              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: F
data:
FLUORINE
S   6
  1  11427.1000000              0.00180093       
  2   1722.3500000              0.0137419        
  3    395.7460000              0.0681334        
  4    115.1390000              0.2333250        
  5     33.6026000              0.5890860        
  6      4.9190100              0.2995050        
L   3
  1     55.4441000              0.1145360              0.0354609        
  2     12.6323000              0.9205120              0.2374510        
  3      3.7175600             -0.00337804             0.8204580        
L   1
  1      1.1654500              1.0000000              1.0000000        
L   1
  1      0.3218920              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Ne
data:
NEON
S   6
  1  13995.7000000              0.00183276       
  2   2117.1000000              0.0138827        
  3    490.4250000              0.0680687        
  4    143.8330000              0.2313280        
  5     41.9265000              0.5858900        
  6      6.1568400              0.3058830        
L   3
  1     69.1211000              0.1191490              0.0356574        
  2     15.8350000              0.9173750              0.2394770        
  3      4.6732600             -0.00405839             0.8184610        
L   1
  1      1.4575600              1.0000000              1.0000000        
L   1
  1      0.3970570              1.0000000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Na
data:
SODIUM
S   6
  1  36166.4000000              0.0010320        
  2   5372.5800000              0.0080710        
  3   1213.2100000              0.0421290        
  4    339.6230000              0.1697890        
  5    109.5530000              0.5146210        
  6     38.7773000              0.3798170        
S   3
  1     38.7773000              0.3747620        
  2     14.5759000              0.5757690        
  3      5.2699300              0.1129330        
S   1
  1      1.8277700              1.0000000        
S   1
  1      0.6199480              1.0000000        
S   1
  1      0.0572400              1.0000000        
S   1
  1      0.0240480              1.0000000        
P   4
  1    144.6450000              0.0114850        
  2     33.9074000              0.0823830        
  3     10.6285000              0.3196580        
  4      3.8238900              0.7012950        
P   2
  1      1.4442900              0.6385060        
  2      0.5526210              0.4253650        
P   1
  1      0.1887200              1.0000000        
P   1
  1      0.0465010              1.0000000        
P   1
  1      0.0162850              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Mg
data:
MAGNESIUM
S   6
  1  43866.5000000              0.0009180        
  2   6605.3700000              0.0070470        
  3   1513.2600000              0.0359410        
  4    432.3170000              0.1414610        
  5    142.1490000              0.4267640        
  6     51.3983000              0.4979750        
S   3
  1     51.3983000              0.2513550        
  2     19.9196000              0.6186710        
  3      8.0247400              0.1884170        
S   1
  1      2.5081700              1.0000000        
S   1
  1      0.8715310              1.0000000        
S   1
  1      0.1081880              1.0000000        
S   1
  1      0.0401300              1.0000000        
P   4
  1    193.8540000              0.0101880        
  2     45.4420000              0.0753600        
  3     14.1864000              0.3074190        
  4      5.0575100              0.7175750        
P   2
  1      1.8886100              0.6673390        
  2      0.7226520              0.3946490        
P   1
  1      0.2364170              1.0000000        
P   1
  1      0.0933580              1.0000000        
P   1
  1      0.0348090              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Al
data:
ALUMINUM
S   6
  1  54866.4890000              0.0008390        
  2   8211.7665000              0.0065270        
  3   1866.1761000              0.0336660        
  4    531.1293400              0.1329020        
  5    175.1179700              0.4012660        
  6     64.0055000              0.5313380        
S   3
  1     64.0055000              0.2023050        
  2     25.2925070              0.6247900        
  3     10.5349100              0.2274390        
S   1
  1      3.2067110              1.0000000        
S   1
  1      1.1525550              1.0000000        
S   1
  1      0.1766780              1.0000000        
S   1
  1      0.0652370              1.0000000        
P   4
  1    259.2836200              0.0094480        
  2     61.0768700              0.0709740        
  3     19.3032370              0.2956360        
  4      7.0108820              0.7282190        
P   2
  1      2.6738650              0.6444670        
  2      1.0365960              0.4174130        
P   1
  1      0.3168190              1.0000000        
P   1
  1      0.1142570              1.0000000        
P   1
  1      0.0413970              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Si
data:
SILICON
S   6
  1  69379.2300000              0.0007570        
  2  10354.9400000              0.0059320        
  3   2333.8796000              0.0310880        
  4    657.1429500              0.1249670        
  5    214.3011300              0.3868970        
  6     77.6291680              0.5548880        
S   3
  1     77.6291680              0.1778810        
  2     30.6308070              0.6277650        
  3     12.8012950              0.2476230        
S   1
  1      3.9268660              1.0000000        
S   1
  1      1.4523430              1.0000000        
S   1
  1      0.2562340              1.0000000        
S   1
  1      0.0942790              1.0000000        
P   4
  1    335.4831900              0.0088660        
  2     78.9003660              0.0682990        
  3     24.9881500              0.2909580        
  4      9.2197110              0.7321170        
P   2
  1      3.6211400              0.6198790        
  2      1.4513100              0.4391480        
P   1
  1      0.5049770              1.0000000        
P   1
  1      0.1863170              1.0000000        
P   1
  1      0.0654320              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: P
data:
PHOSPHORUS
S   6
  1  77492.4000000              0.0007810        
  2  11605.8000000              0.0060680        
  3   2645.9600000              0.0311600        
  4    754.9760000              0.1234310        
  5    248.7550000              0.3782090        
  6     91.1565000              0.5632620        
S   3
  1     91.1565000              0.1602550        
  2     36.2257000              0.6276470        
  3     15.2113000              0.2638490        
S   1
  1      4.7941700              1.0000000        
S   1
  1      1.8079300              1.0000000        
S   1
  1      0.3568160              1.0000000        
S   1
  1      0.1147830              1.0000000        
P   4
  1    384.8430000              0.0092060        
  2     90.5521000              0.0698740        
  3     29.1339000              0.2924700        
  4     10.8862000              0.7281030        
P   2
  1      4.3525900              0.6283490        
  2      1.7770600              0.4280440        
P   1
  1      0.6970050              1.0000000        
P   1
  1      0.2535320              1.0000000        
P   1
  1      0.0684930              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: S
data:
SULFUR
S   6
  1  93413.4000000              0.0007430        
  2  13961.7000000              0.0057930        
  3   3169.9100000              0.0299540        
  4    902.4560000              0.1190280        
  5    297.1580000              0.3684320        
  6    108.7020000              0.5772990        
S   3
  1    108.7020000              0.1431860        
  2     43.1553000              0.6244650        
  3     18.1079000              0.2833660        
S   1
  1      5.5600900              1.0000000        
S   1
  1      2.1318300              1.0000000        
S   1
  1      0.4204030              1.0000000        
S   1
  1      0.1360450              1.0000000        
P   4
  1    495.0400000              0.0083090        
  2    117.2210000              0.0640240        
  3     37.7749000              0.2776140        
  4     14.0584000              0.7450760        
P   2
  1      5.5657400              0.6137120        
  2      2.2629700              0.4438180        
P   1
  1      0.8079940              1.0000000        
P   1
  1      0.2774600              1.0000000        
P   1
  1      0.0771410              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Cl
data:
CHLORINE
S   6
  1 105819.0000000              0.0007380        
  2  15872.0000000              0.0057180        
  3   3619.6500000              0.0294950        
  4   1030.8000000              0.1172860        
  5    339.9080000              0.3629490        
  6    124.5380000              0.5841490        
S   3
  1    124.5380000              0.1341770        
  2     49.5135000              0.6242500        
  3     20.8056000              0.2917560        
S   1
  1      6.5834600              1.0000000        
S   1
  1      2.5646800              1.0000000        
S   1
  1      0.5597630              1.0000000        
S   1
  1      0.1832730              1.0000000        
P   5
  1    589.7760000              0.0023910        
  2    139.8490000              0.0185040        
  3     45.1413000              0.0813770        
  4     16.8733000              0.2215520        
  5      6.7411000              0.7725690        
P   2
  1      6.7411000             -1.5722440        
  2      2.7715200              0.9923890        
P   1
  1      1.0238700              1.0000000        
P   1
  1      0.3813680              1.0000000        
P   1
  1      0.1094370              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Ar
data:
ARGON
S   6
  1 118022.3800000              0.0007470        
  2  17683.5410000              0.0057900        
  3   4027.7657000              0.0299190        
  4   1145.3977000              0.1192060        
  5    377.1637500              0.3690280        
  6    138.1596900              0.5764590        
S   3
  1    138.1596900              0.1439270        
  2     54.9891170              0.6229380        
  3     23.1706670              0.2839640        
S   1
  1      7.3778600              1.0000000        
S   1
  1      2.9236880              1.0000000        
S   1
  1      0.6504050              1.0000000        
S   1
  1      0.2328250              1.0000000        
P   5
  1    663.0620100              0.0030820        
  2    157.0928100              0.0241650        
  3     50.2311000              0.1082230        
  4     18.6353450              0.2941920        
  5      7.4465370              0.6878620        
P   2
  1      7.4465370             -0.1214482        
  2      3.0956980              0.1632370        
P   1
  1      1.1064630              1.0000000        
P   1
  1      0.4156010              1.0000000        
P   1
  1      0.1454490              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: K
data:
POTASSIUM
S   6
  1 182594.0000000              0.000227747      
  2  27369.0000000              0.00176640       
  3   6229.1700000              0.00919497       
  4   1764.5800000              0.03745510       
  5    577.0510000              0.12204500       
  6    210.2490000              0.29899000       
S   2
  1     82.6178000              0.4051470        
  2     33.2332000              0.2925320        
S   1
  1      8.1064900              1.0000000        
S   1
  1      3.3340300              1.0000000        
S   1
  1      0.8455440              1.0000000        
S   1
  1      0.3282160              1.0000000        
S   1
  1      0.0364035              1.0000000        
S   1
  1      0.0176463              1.0000000        
P   3
  1    891.0540000              0.00218429       
  2    211.0160000              0.0175891        
  3     67.6714000              0.0817775        
P   3
  1     25.2715000              0.2456560        
  2     10.1390000              0.4339840        
  3      4.2018600              0.3623770        
P   1
  1      1.6250700              1.0000000        
P   1
  1      0.6437700              1.0000000        
P   1
  1      0.2461300              1.0000000        
P   1
  1      0.0454400              1.0000000        
P   1
  1      0.0161600              1.0000000        
D   3
  1     13.3700000              0.0316016        
  2      3.4210000              0.1568790        
  3      1.0630000              0.3905820


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Ca
data:
CALCIUM
S   6
  1 202699.0000000              0.000222964      
  2  30382.5000000              0.00172932       
  3   6915.0800000              0.00900226       
  4   1959.0200000              0.0366699        
  5    640.9360000              0.1194100        
  6    233.9770000              0.2918250        
S   2
  1     92.2892000              0.4044150        
  2     37.2545000              0.2963130        
S   1
  1      9.1319800              1.0000000        
S   1
  1      3.8177900              1.0000000        
S   1
  1      1.0493500              1.0000000        
S   1
  1      0.4286600              1.0000000        
S   1
  1      0.0628226              1.0000000        
S   1
  1      0.0260162              1.0000000        
P   3
  1   1019.7600000              0.00205986       
  2    241.5960000              0.01665010       
  3     77.6370000              0.07776460       
P   3
  1     29.1154000              0.2418060        
  2     11.7626000              0.4325780        
  3      4.9228900              0.3673250        
P   1
  1      1.9064500              1.0000000        
P   1
  1      0.7369000              1.0000000        
P   1
  1      0.2764200              1.0000000        
P   1
  1      0.0602700              1.0000000        
P   1
  1      0.0179100              1.0000000        
D   3
  1     15.0800000              0.0368947        
  2      3.9260000              0.1778200        
  3      1.2330000              0.4255130


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Ga
data:
GALLIUM
S   6
  1 333800.0000000              0.00083805       
  2  50100.0000000              0.00624660       
  3  11510.0000000              0.03202800       
  4   3292.0000000              0.12709000       
  5   1089.0000000              0.39092000       
  6    401.0000000              0.54643000       
S   3
  1    401.0000000              0.1807800        
  2    159.3000000              0.6223900        
  3     67.5900000              0.2495300        
S   1
  1     24.8900000              1.0000000        
S   1
  1     10.6800000              1.0000000        
S   1
  1      3.3860000              1.0000000        
S   1
  1      1.3310000              1.0000000        
S   1
  1      0.1853000              1.0000000        
S   1
  1      0.0662100              1.0000000        
P   3
  1   2181.0000000              0.0225650        
  2    515.4000000              0.1836300        
  3    164.8000000              0.8598400        
P   3
  1     61.4000000              0.3434500        
  2     24.9800000              0.5056100        
  3     10.4400000              0.2622400        
P   3
  1     10.4400000              0.0641300        
  2      5.5890000              0.3788400        
  3      2.5170000              0.6166900        
P   1
  1      1.0530000              1.0000000        
P   1
  1      0.2915000              1.0000000        
P   1
  1      0.1210000              1.0000000        
P   1
  1      0.0399000              1.0000000        
D   4
  1     67.1400000              0.0309570        
  2     18.9400000              0.1748000        
  3      6.4260000              0.4434600        
  4      2.1900000              0.5670200        
D   1
  1      0.6725000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Ge
data:
GERMANIUM
S   6
  1 357500.0000000              0.00083898       
  2  53670.0000000              0.00626350       
  3  12300.0000000              0.03203600       
  4   3512.0000000              0.12751000       
  5   1161.0000000              0.39165000       
  6    428.0000000              0.54528000       
S   3
  1    428.0000000              0.1816000        
  2    170.0000000              0.6224800        
  3     72.0600000              0.2487200        
S   1
  1     26.6900000              1.0000000        
S   1
  1     11.5000000              1.0000000        
S   1
  1      3.7420000              1.0000000        
S   1
  1      1.4990000              1.0000000        
S   1
  1      0.2292000              1.0000000        
S   1
  1      0.0867500              1.0000000        
P   3
  1   2345.0000000              0.0225140        
  2    554.2000000              0.1833500        
  3    177.3000000              0.8600300        
P   3
  1     66.1300000              0.3430600        
  2     26.9000000              0.5065200        
  3     11.2600000              0.2614100        
P   3
  1     11.2600000              0.0672460        
  2      6.1160000              0.3723800        
  3      2.8190000              0.6176300        
P   1
  1      1.2110000              1.0000000        
P   1
  1      0.3568000              1.0000000        
P   1
  1      0.1621000              1.0000000        
P   1
  1      0.0608400              1.0000000        
D   4
  1     74.8400000              0.0303900        
  2     21.2300000              0.1731900        
  3      7.2970000              0.4409000        
  4      2.5490000              0.5653200        
D   1
  1      0.8165000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: As
data:
ARSENIC
S   6
  1 381200.0000000              0.00083327       
  2  57240.0000000              0.00621980       
  3  13110.0000000              0.03203000       
  4   3743.0000000              0.12729000       
  5   1238.0000000              0.39132000       
  6    456.3000000              0.54581000       
S   3
  1    456.3000000              0.1809700        
  2    181.4000000              0.6218000        
  3     77.0700000              0.2498800        
S   1
  1     28.5700000              1.0000000        
S   1
  1     12.3600000              1.0000000        
S   1
  1      4.1170000              1.0000000        
S   1
  1      1.6780000              1.0000000        
S   1
  1      0.2761000              1.0000000        
S   1
  1      0.1105000              1.0000000        
P   3
  1   2528.0000000              0.0222710        
  2    597.3000000              0.1819900        
  3    190.7000000              0.8613300        
P   3
  1     70.9600000              0.3433800        
  2     28.8900000              0.5059800        
  3     12.1300000              0.2612800        
P   3
  1     12.1300000              0.0685360        
  2      6.5330000              0.3828200        
  3      3.0280000              0.6059900        
P   1
  1      1.3440000              1.0000000        
P   1
  1      0.5823000              1.0000000        
P   1
  1      0.2558000              1.0000000        
P   1
  1      0.0865100              1.0000000        
D   4
  1     86.0500000              0.0279890        
  2     24.4900000              0.1650200        
  3      8.4420000              0.4373600        
  4      2.9810000              0.5725500        
D   1
  1      0.9790000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Se
data:
SELENIUM
S   6
  1 405400.0000000              0.0008310        
  2  60850.0000000              0.0062331        
  3  13910.0000000              0.0320710        
  4   3989.0000000              0.1263600        
  5   1324.0000000              0.3889900        
  6    487.0000000              0.5488800        
S   3
  1    487.0000000              0.1796300        
  2    193.2000000              0.6222700        
  3     82.1900000              0.2506700        
S   1
  1     30.5200000              1.0000000        
S   1
  1     13.2500000              1.0000000        
S   1
  1      4.5100000              1.0000000        
S   1
  1      1.8670000              1.0000000        
S   1
  1      0.3190000              1.0000000        
S   1
  1      0.1120000              1.0000000        
P   3
  1   2706.0000000              0.0221460        
  2    638.6000000              0.1818000        
  3    203.8000000              0.8615500        
P   3
  1     75.9600000              0.3424300        
  2     31.0200000              0.5054100        
  3     13.0500000              0.2623700        
P   3
  1     13.0500000              0.0701630        
  2      6.9860000              0.3841900        
  3      3.2340000              0.6036800        
P   1
  1      1.4750000              1.0000000        
P   1
  1      0.7275000              1.0000000        
P   1
  1      0.2869000              1.0000000        
P   1
  1      0.0967900              1.0000000        
D   4
  1     99.0100000              0.0255960        
  2     28.4100000              0.1545900        
  3      9.8630000              0.4287800        
  4      3.5140000              0.5862000        
D   1
  1      1.1710000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Br
data:
BROMINE
S   6
  1 439700.0000000              0.0008130        
  2  66030.0000000              0.0062850        
  3  15140.0000000              0.0319200        
  4   4317.0000000              0.1288000        
  5   1414.0000000              0.3946000        
  6    523.9000000              0.5413000        
S   3
  1    523.9000000              0.1831000        
  2    207.7000000              0.6176000        
  3     86.5400000              0.2538000        
S   1
  1     30.5200000              1.0000000        
S   1
  1     12.9800000              1.0000000        
S   1
  1      4.4120000              1.0000000        
S   1
  1      1.8620000              1.0000000        
S   1
  1      0.3932000              1.0000000        
S   1
  1      0.1400000              1.0000000        
P   3
  1   2957.0000000              0.0222600        
  2    700.3000000              0.1802000        
  3    224.6000000              0.8624000        
P   3
  1     82.5900000              0.3440000        
  2     33.1900000              0.5071000        
  3     14.2000000              0.2590000        
P   3
  1     14.2000000              0.0796500        
  2      7.4380000              0.3734000        
  3      3.5260000              0.6049000        
P   1
  1      1.5950000              1.0000000        
P   1
  1      0.8462000              1.0000000        
P   1
  1      0.3186000              1.0000000        
P   1
  1      0.1096000              1.0000000        
D   4
  1    134.8000000              0.0183100        
  2     36.3900000              0.1350000        
  3     12.1600000              0.4261000        
  4      4.3410000              0.6043000        
D   1
  1      1.5350000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: Kr
data:
KRYPTON
S   6
  1 456200.0000000              0.0008111        
  2  68460.0000000              0.0062552        
  3  15650.0000000              0.0320220        
  4   4500.0000000              0.1254600        
  5   1497.0000000              0.3866600        
  6    550.5000000              0.5518800        
S   3
  1    550.5000000              0.1771100        
  2    218.2000000              0.6224800        
  3     92.9700000              0.2527900        
S   1
  1     34.5900000              1.0000000        
S   1
  1     15.1200000              1.0000000        
S   1
  1      5.3460000              1.0000000        
S   1
  1      2.2730000              1.0000000        
S   1
  1      0.4841000              1.0000000        
S   1
  1      0.1849000              1.0000000        
P   3
  1   3074.0000000              0.0219980        
  2    725.7000000              0.1810200        
  3    231.5000000              0.8622300        
P   3
  1     86.4500000              0.3415500        
  2     35.5500000              0.5025500        
  3     15.1400000              0.2645300        
P   3
  1     15.1400000              0.0716700        
  2      8.0310000              0.3970800        
  3      3.7990000              0.5876200        
P   1
  1      1.8490000              1.0000000        
P   1
  1      0.8676000              1.0000000        
P   1
  1      0.3329000              1.0000000        
P   1
  1      0.1199000              1.0000000        
D   4
  1    122.5000000              0.0233770        
  2     35.3700000              0.1461000        
  3     12.3900000              0.4223000        
  4      4.4960000              0.5945200        
D   1
  1      1.5460000              1.0000000


name: 6-311G
description: VTZ Valence Triple Zeta: 3 Funct.'s/Valence AO
elt: I
data:
IODINE
S   5
  1 444750.0000000              0.0008900        
  2  66127.0000000              0.0069400        
  3  14815.0000000              0.0360900        
  4   4144.9000000              0.1356800        
  5   1361.2000000              0.3387800        
S   2
  1    508.4400000              0.4365900        
  2    209.5900000              0.1837500        
S   1
  1     81.9590000              1.0000000        
S   1
  1     36.8050000              1.0000000        
S   1
  1     13.4950000              1.0000000        
S   1
  1      6.8859000              1.0000000        
S   1
  1      2.5520000              1.0000000        
S   1
  1      1.2088000              1.0000000        
S   1
  1      0.2734000              1.0000000        
S   1
  1      0.1009000              1.0000000        
P   4
  1   2953.6000000              0.0122100        
  2    712.6100000              0.0858700        
  3    236.7100000              0.2949300        
  4     92.6310000              0.4784900        
P   1
  1     39.7320000              1.0000000        
P   1
  1     17.2730000              1.0000000        
P   1
  1      7.9570000              1.0000000        
P   1
  1      3.1529000              1.0000000        
P   1
  1      1.3328000              1.0000000        
P   1
  1      0.4947000              1.0000000        
P   1
  1      0.2160000              1.0000000        
P   1
  1      0.0829300              1.0000000        
D   3
  1    261.9500000              0.0314400        
  2     76.7340000              0.1902800        
  3     27.5510000              0.4724700        
D   1
  1     10.6060000              1.0000000        
D   1
  1      3.4217000              1.0000000        
D   1
  1      1.1370000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: H
data:
HYDROGEN
S   3
  1     33.8650000              0.0254938        
  2      5.0947900              0.1903730        
  3      1.1587900              0.8521610        
S   1
  1      0.3258400              1.0000000        
S   1
  1      0.1027410              1.0000000        
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000        
D   1
  1      1.0000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: He
data:
HELIUM
S   3
  1     98.1243000              0.0287452        
  2     14.7689000              0.2080610        
  3      3.3188300              0.8376350        
S   1
  1      0.8740470              1.0000000        
S   1
  1      0.2445640              1.0000000        
P   1
  1      1.5000000              1.0000000        
P   1
  1      0.3750000              1.0000000        
D   1
  1      2.0000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: Li
data:
LITHIUM
S   6
  1    900.4600000              0.00228704       
  2    134.4330000              0.0176350        
  3     30.4365000              0.0873434        
  4      8.6263900              0.2809770        
  5      2.4833200              0.6587410        
  6      0.3031790              0.1187120        
L   3
  1      4.8689000              0.0933293              0.0327661        
  2      0.8569240              0.9430450              0.1597920        
  3      0.2432270             -0.00279827             0.8856670        
L   1
  1      0.0635070              1.0000000              1.0000000        
L   1
  1      0.0243683              1.0000000              1.0000000        
D   1
  1      0.4000000              1.0000000        
D   1
  1      0.1000000              1.0000000        
F   1
  1      0.1500000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: Be
data:
BERYLLIUM
S   6
  1   1682.8000000              0.00228574       
  2    251.7150000              0.0175938        
  3     57.4116000              0.0863315        
  4     16.5171000              0.2818350        
  5      4.8536400              0.6405940        
  6      0.6268630              0.1444670        
L   3
  1      8.3093800              0.1086210              0.0361344        
  2      1.7407500              0.9273010              0.2169580        
  3      0.4858160             -0.00297169             0.8418390        
L   1
  1      0.1636130              1.0000000              1.0000000        
L   1
  1      0.0567285              1.0000000              1.0000000        
D   1
  1      0.5100000              1.0000000        
D   1
  1      0.1275000              1.0000000        
F   1
  1      0.2600000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: B
data:
BORON
S   6
  1   2858.8900000              0.00215375       
  2    428.1400000              0.0165823        
  3     97.5282000              0.0821870        
  4     27.9693000              0.2766180        
  5      8.2157700              0.6293160        
  6      1.1127800              0.1737700        
L   3
  1     13.2415000              0.1174430              0.0418100        
  2      3.0016600              0.9180020              0.2365750        
  3      0.9128560             -0.00265105             0.8162140        
L   1
  1      0.3154540              1.0000000              1.0000000        
L   1
  1      0.0988563              1.0000000              1.0000000        
D   1
  1      0.8020000              1.0000000        
D   1
  1      0.2005000              1.0000000        
F   1
  1      0.5000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: C
data:
CARBON
S   6
  1   4563.2400000              0.00196665       
  2    682.0240000              0.0152306        
  3    154.9730000              0.0761269        
  4     44.4553000              0.2608010        
  5     13.0290000              0.6164620        
  6      1.8277300              0.2210060        
L   3
  1     20.9642000              0.1146600              0.0402487        
  2      4.8033100              0.9199990              0.2375940        
  3      1.4593300             -0.00303068             0.8158540        
L   1
  1      0.4834560              1.0000000              1.0000000        
L   1
  1      0.1455850              1.0000000              1.0000000        
D   1
  1      1.2520000              1.0000000        
D   1
  1      0.3130000              1.0000000        
F   1
  1      0.8000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: N
data:
NITROGEN
S   6
  1   6293.4800000              0.00196979       
  2    949.0440000              0.0149613        
  3    218.7760000              0.0735006        
  4     63.6916000              0.2489370        
  5     18.8282000              0.6024600        
  6      2.7202300              0.2562020        
L   3
  1     30.6331000              0.1119060              0.0383119        
  2      7.0261400              0.9216660              0.2374030        
  3      2.1120500             -0.00256919             0.8175920        
L   1
  1      0.6840090              1.0000000              1.0000000        
L   1
  1      0.2008780              1.0000000              1.0000000        
D   1
  1      1.8260000              1.0000000        
D   1
  1      0.4565000              1.0000000        
F   1
  1      1.0000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: O
data:
OXYGEN
S   6
  1   8588.5000000              0.00189515       
  2   1297.2300000              0.0143859        
  3    299.2960000              0.0707320        
  4     87.3771000              0.2400010        
  5     25.6789000              0.5947970        
  6      3.7400400              0.2808020        
L   3
  1     42.1175000              0.1138890              0.0365114        
  2      9.6283700              0.9208110              0.2371530        
  3      2.8533200             -0.00327447             0.8197020        
L   1
  1      0.9056610              1.0000000              1.0000000        
L   1
  1      0.2556110              1.0000000              1.0000000        
D   1
  1      2.5840000              1.0000000        
D   1
  1      0.6460000              1.0000000        
F   1
  1      1.4000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: F
data:
FLUORINE
S   6
  1  11427.1000000              0.00180093       
  2   1722.3500000              0.0137419        
  3    395.7460000              0.0681334        
  4    115.1390000              0.2333250        
  5     33.6026000              0.5890860        
  6      4.9190100              0.2995050        
L   3
  1     55.4441000              0.1145360              0.0354609        
  2     12.6323000              0.9205120              0.2374510        
  3      3.7175600             -0.00337804             0.8204580        
L   1
  1      1.1654500              1.0000000              1.0000000        
L   1
  1      0.3218920              1.0000000              1.0000000        
D   1
  1      3.5000000              1.0000000        
D   1
  1      0.8750000              1.0000000        
F   1
  1      1.8500000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: Ne
data:
NEON
S   6
  1  13995.7000000              0.00183276       
  2   2117.1000000              0.0138827        
  3    490.4250000              0.0680687        
  4    143.8330000              0.2313280        
  5     41.9265000              0.5858900        
  6      6.1568400              0.3058830        
L   3
  1     69.1211000              0.1191490              0.0356574        
  2     15.8350000              0.9173750              0.2394770        
  3      4.6732600             -0.00405839             0.8184610        
L   1
  1      1.4575600              1.0000000              1.0000000        
L   1
  1      0.3970570              1.0000000              1.0000000        
D   1
  1      4.6080000              1.0000000        
D   1
  1      1.1520000              1.0000000        
F   1
  1      2.5000000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: K
data:
POTASSIUM
S   6
  1 182594.0000000              0.000227747      
  2  27369.0000000              0.00176640       
  3   6229.1700000              0.00919497       
  4   1764.5800000              0.03745510       
  5    577.0510000              0.12204500       
  6    210.2490000              0.29899000       
S   2
  1     82.6178000              0.4051470        
  2     33.2332000              0.2925320        
S   1
  1      8.1064900              1.0000000        
S   1
  1      3.3340300              1.0000000        
S   1
  1      0.8455440              1.0000000        
S   1
  1      0.3282160              1.0000000        
S   1
  1      0.0364035              1.0000000        
S   1
  1      0.0176463              1.0000000        
P   3
  1    891.0540000              0.00218429       
  2    211.0160000              0.0175891        
  3     67.6714000              0.0817775        
P   3
  1     25.2715000              0.2456560        
  2     10.1390000              0.4339840        
  3      4.2018600              0.3623770        
P   1
  1      1.6250700              1.0000000        
P   1
  1      0.6437700              1.0000000        
P   1
  1      0.2461300              1.0000000        
P   1
  1      0.0454400              1.0000000        
P   1
  1      0.0161600              1.0000000        
D   3
  1     13.3700000              0.0316016        
  2      3.4210000              0.1568790        
  3      1.0630000              0.3905820        
D   1
  1      0.4580000              1.0000000        
D   1
  1      0.1145000              1.0000000        
F   1
  1      1.1100000              1.0000000


name: 6-311G(2df,2pd)
description: VTZ2P Valence Triple Zeta + Double Polarization
elt: Ca
data:
CALCIUM
S   6
  1 202699.0000000              0.000222964      
  2  30382.5000000              0.00172932       
  3   6915.0800000              0.00900226       
  4   1959.0200000              0.0366699        
  5    640.9360000              0.1194100        
  6    233.9770000              0.2918250        
S   2
  1     92.2892000              0.4044150        
  2     37.2545000              0.2963130        
S   1
  1      9.1319800              1.0000000        
S   1
  1      3.8177900              1.0000000        
S   1
  1      1.0493500              1.0000000        
S   1
  1      0.4286600              1.0000000        
S   1
  1      0.0628226              1.0000000        
S   1
  1      0.0260162              1.0000000        
P   3
  1   1019.7600000              0.00205986       
  2    241.5960000              0.01665010       
  3     77.6370000              0.07776460       
P   3
  1     29.1154000              0.2418060        
  2     11.7626000              0.4325780        
  3      4.9228900              0.3673250        
P   1
  1      1.9064500              1.0000000        
P   1
  1      0.7369000              1.0000000        
P   1
  1      0.2764200              1.0000000        
P   1
  1      0.0602700              1.0000000        
P   1
  1      0.0179100              1.0000000        
D   3
  1     15.0800000              0.0368947        
  2      3.9260000              0.1778200        
  3      1.2330000              0.4255130        
D   1
  1      0.5200000              1.0000000        
D   1
  1      0.1300000              1.0000000        
F   1
  1      1.3300000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Li
data:
LITHIUM
S   6
  1    900.4600000              0.00228704       
  2    134.4330000              0.0176350        
  3     30.4365000              0.0873434        
  4      8.6263900              0.2809770        
  5      2.4833200              0.6587410        
  6      0.3031790              0.1187120        
L   3
  1      4.8689000              0.0933293              0.0327661        
  2      0.8569240              0.9430450              0.1597920        
  3      0.2432270             -0.00279827             0.8856670        
L   1
  1      0.0635070              1.0000000              1.0000000        
L   1
  1      0.0243683              1.0000000              1.0000000        
D   1
  1      0.2000000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Be
data:
BERYLLIUM
S   6
  1   1682.8000000              0.00228574       
  2    251.7150000              0.0175938        
  3     57.4116000              0.0863315        
  4     16.5171000              0.2818350        
  5      4.8536400              0.6405940        
  6      0.6268630              0.1444670        
L   3
  1      8.3093800              0.1086210              0.0361344        
  2      1.7407500              0.9273010              0.2169580        
  3      0.4858160             -0.00297169             0.8418390        
L   1
  1      0.1636130              1.0000000              1.0000000        
L   1
  1      0.0567285              1.0000000              1.0000000        
D   1
  1      0.2550000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: B
data:
BORON
S   6
  1   2858.8900000              0.00215375       
  2    428.1400000              0.0165823        
  3     97.5282000              0.0821870        
  4     27.9693000              0.2766180        
  5      8.2157700              0.6293160        
  6      1.1127800              0.1737700        
L   3
  1     13.2415000              0.1174430              0.0418100        
  2      3.0016600              0.9180020              0.2365750        
  3      0.9128560             -0.00265105             0.8162140        
L   1
  1      0.3154540              1.0000000              1.0000000        
L   1
  1      0.0988563              1.0000000              1.0000000        
D   1
  1      0.4010000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: C
data:
CARBON
S   6
  1   4563.2400000              0.00196665       
  2    682.0240000              0.0152306        
  3    154.9730000              0.0761269        
  4     44.4553000              0.2608010        
  5     13.0290000              0.6164620        
  6      1.8277300              0.2210060        
L   3
  1     20.9642000              0.1146600              0.0402487        
  2      4.8033100              0.9199990              0.2375940        
  3      1.4593300             -0.00303068             0.8158540        
L   1
  1      0.4834560              1.0000000              1.0000000        
L   1
  1      0.1455850              1.0000000              1.0000000        
D   1
  1      0.6260000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: N
data:
NITROGEN
S   6
  1   6293.4800000              0.00196979       
  2    949.0440000              0.0149613        
  3    218.7760000              0.0735006        
  4     63.6916000              0.2489370        
  5     18.8282000              0.6024600        
  6      2.7202300              0.2562020        
L   3
  1     30.6331000              0.1119060              0.0383119        
  2      7.0261400              0.9216660              0.2374030        
  3      2.1120500             -0.00256919             0.8175920        
L   1
  1      0.6840090              1.0000000              1.0000000        
L   1
  1      0.2008780              1.0000000              1.0000000        
D   1
  1      0.9130000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: O
data:
OXYGEN
S   6
  1   8588.5000000              0.00189515       
  2   1297.2300000              0.0143859        
  3    299.2960000              0.0707320        
  4     87.3771000              0.2400010        
  5     25.6789000              0.5947970        
  6      3.7400400              0.2808020        
L   3
  1     42.1175000              0.1138890              0.0365114        
  2      9.6283700              0.9208110              0.2371530        
  3      2.8533200             -0.00327447             0.8197020        
L   1
  1      0.9056610              1.0000000              1.0000000        
L   1
  1      0.2556110              1.0000000              1.0000000        
D   1
  1      1.2920000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: F
data:
FLUORINE
S   6
  1  11427.1000000              0.00180093       
  2   1722.3500000              0.0137419        
  3    395.7460000              0.0681334        
  4    115.1390000              0.2333250        
  5     33.6026000              0.5890860        
  6      4.9190100              0.2995050        
L   3
  1     55.4441000              0.1145360              0.0354609        
  2     12.6323000              0.9205120              0.2374510        
  3      3.7175600             -0.00337804             0.8204580        
L   1
  1      1.1654500              1.0000000              1.0000000        
L   1
  1      0.3218920              1.0000000              1.0000000        
D   1
  1      1.7500000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Ne
data:
NEON
S   6
  1  13995.7000000              0.00183276       
  2   2117.1000000              0.0138827        
  3    490.4250000              0.0680687        
  4    143.8330000              0.2313280        
  5     41.9265000              0.5858900        
  6      6.1568400              0.3058830        
L   3
  1     69.1211000              0.1191490              0.0356574        
  2     15.8350000              0.9173750              0.2394770        
  3      4.6732600             -0.00405839             0.8184610        
L   1
  1      1.4575600              1.0000000              1.0000000        
L   1
  1      0.3970570              1.0000000              1.0000000        
D   1
  1      2.3040000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Na
data:
SODIUM
S   6
  1  36166.4000000              0.0010320        
  2   5372.5800000              0.0080710        
  3   1213.2100000              0.0421290        
  4    339.6230000              0.1697890        
  5    109.5530000              0.5146210        
  6     38.7773000              0.3798170        
S   3
  1     38.7773000              0.3747620        
  2     14.5759000              0.5757690        
  3      5.2699300              0.1129330        
S   1
  1      1.8277700              1.0000000        
S   1
  1      0.6199480              1.0000000        
S   1
  1      0.0572400              1.0000000        
S   1
  1      0.0240480              1.0000000        
P   4
  1    144.6450000              0.0114850        
  2     33.9074000              0.0823830        
  3     10.6285000              0.3196580        
  4      3.8238900              0.7012950        
P   2
  1      1.4442900              0.6385060        
  2      0.5526210              0.4253650        
P   1
  1      0.1887200              1.0000000        
P   1
  1      0.0465010              1.0000000        
P   1
  1      0.0162850              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Mg
data:
MAGNESIUM
S   6
  1  43866.5000000              0.0009180        
  2   6605.3700000              0.0070470        
  3   1513.2600000              0.0359410        
  4    432.3170000              0.1414610        
  5    142.1490000              0.4267640        
  6     51.3983000              0.4979750        
S   3
  1     51.3983000              0.2513550        
  2     19.9196000              0.6186710        
  3      8.0247400              0.1884170        
S   1
  1      2.5081700              1.0000000        
S   1
  1      0.8715310              1.0000000        
S   1
  1      0.1081880              1.0000000        
S   1
  1      0.0401300              1.0000000        
P   4
  1    193.8540000              0.0101880        
  2     45.4420000              0.0753600        
  3     14.1864000              0.3074190        
  4      5.0575100              0.7175750        
P   2
  1      1.8886100              0.6673390        
  2      0.7226520              0.3946490        
P   1
  1      0.2364170              1.0000000        
P   1
  1      0.0933580              1.0000000        
P   1
  1      0.0348090              1.0000000        
D   1
  1      0.1750000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Al
data:
ALUMINUM
S   6
  1  54866.4890000              0.0008390        
  2   8211.7665000              0.0065270        
  3   1866.1761000              0.0336660        
  4    531.1293400              0.1329020        
  5    175.1179700              0.4012660        
  6     64.0055000              0.5313380        
S   3
  1     64.0055000              0.2023050        
  2     25.2925070              0.6247900        
  3     10.5349100              0.2274390        
S   1
  1      3.2067110              1.0000000        
S   1
  1      1.1525550              1.0000000        
S   1
  1      0.1766780              1.0000000        
S   1
  1      0.0652370              1.0000000        
P   4
  1    259.2836200              0.0094480        
  2     61.0768700              0.0709740        
  3     19.3032370              0.2956360        
  4      7.0108820              0.7282190        
P   2
  1      2.6738650              0.6444670        
  2      1.0365960              0.4174130        
P   1
  1      0.3168190              1.0000000        
P   1
  1      0.1142570              1.0000000        
P   1
  1      0.0413970              1.0000000        
D   1
  1      0.3250000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Si
data:
SILICON
S   6
  1  69379.2300000              0.0007570        
  2  10354.9400000              0.0059320        
  3   2333.8796000              0.0310880        
  4    657.1429500              0.1249670        
  5    214.3011300              0.3868970        
  6     77.6291680              0.5548880        
S   3
  1     77.6291680              0.1778810        
  2     30.6308070              0.6277650        
  3     12.8012950              0.2476230        
S   1
  1      3.9268660              1.0000000        
S   1
  1      1.4523430              1.0000000        
S   1
  1      0.2562340              1.0000000        
S   1
  1      0.0942790              1.0000000        
P   4
  1    335.4831900              0.0088660        
  2     78.9003660              0.0682990        
  3     24.9881500              0.2909580        
  4      9.2197110              0.7321170        
P   2
  1      3.6211400              0.6198790        
  2      1.4513100              0.4391480        
P   1
  1      0.5049770              1.0000000        
P   1
  1      0.1863170              1.0000000        
P   1
  1      0.0654320              1.0000000        
D   1
  1      0.4500000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: P
data:
PHOSPHORUS
S   6
  1  77492.4000000              0.0007810        
  2  11605.8000000              0.0060680        
  3   2645.9600000              0.0311600        
  4    754.9760000              0.1234310        
  5    248.7550000              0.3782090        
  6     91.1565000              0.5632620        
S   3
  1     91.1565000              0.1602550        
  2     36.2257000              0.6276470        
  3     15.2113000              0.2638490        
S   1
  1      4.7941700              1.0000000        
S   1
  1      1.8079300              1.0000000        
S   1
  1      0.3568160              1.0000000        
S   1
  1      0.1147830              1.0000000        
P   4
  1    384.8430000              0.0092060        
  2     90.5521000              0.0698740        
  3     29.1339000              0.2924700        
  4     10.8862000              0.7281030        
P   2
  1      4.3525900              0.6283490        
  2      1.7770600              0.4280440        
P   1
  1      0.6970050              1.0000000        
P   1
  1      0.2535320              1.0000000        
P   1
  1      0.0684930              1.0000000        
D   1
  1      0.5500000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: S
data:
SULFUR
S   6
  1  93413.4000000              0.0007430        
  2  13961.7000000              0.0057930        
  3   3169.9100000              0.0299540        
  4    902.4560000              0.1190280        
  5    297.1580000              0.3684320        
  6    108.7020000              0.5772990        
S   3
  1    108.7020000              0.1431860        
  2     43.1553000              0.6244650        
  3     18.1079000              0.2833660        
S   1
  1      5.5600900              1.0000000        
S   1
  1      2.1318300              1.0000000        
S   1
  1      0.4204030              1.0000000        
S   1
  1      0.1360450              1.0000000        
P   4
  1    495.0400000              0.0083090        
  2    117.2210000              0.0640240        
  3     37.7749000              0.2776140        
  4     14.0584000              0.7450760        
P   2
  1      5.5657400              0.6137120        
  2      2.2629700              0.4438180        
P   1
  1      0.8079940              1.0000000        
P   1
  1      0.2774600              1.0000000        
P   1
  1      0.0771410              1.0000000        
D   1
  1      0.6500000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Cl
data:
CHLORINE
S   6
  1 105819.0000000              0.0007380        
  2  15872.0000000              0.0057180        
  3   3619.6500000              0.0294950        
  4   1030.8000000              0.1172860        
  5    339.9080000              0.3629490        
  6    124.5380000              0.5841490        
S   3
  1    124.5380000              0.1341770        
  2     49.5135000              0.6242500        
  3     20.8056000              0.2917560        
S   1
  1      6.5834600              1.0000000        
S   1
  1      2.5646800              1.0000000        
S   1
  1      0.5597630              1.0000000        
S   1
  1      0.1832730              1.0000000        
P   5
  1    589.7760000              0.0023910        
  2    139.8490000              0.0185040        
  3     45.1413000              0.0813770        
  4     16.8733000              0.2215520        
  5      6.7411000              0.7725690        
P   2
  1      6.7411000             -1.5722440        
  2      2.7715200              0.9923890        
P   1
  1      1.0238700              1.0000000        
P   1
  1      0.3813680              1.0000000        
P   1
  1      0.1094370              1.0000000        
D   1
  1      0.7500000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Ar
data:
ARGON
S   6
  1 118022.3800000              0.0007470        
  2  17683.5410000              0.0057900        
  3   4027.7657000              0.0299190        
  4   1145.3977000              0.1192060        
  5    377.1637500              0.3690280        
  6    138.1596900              0.5764590        
S   3
  1    138.1596900              0.1439270        
  2     54.9891170              0.6229380        
  3     23.1706670              0.2839640        
S   1
  1      7.3778600              1.0000000        
S   1
  1      2.9236880              1.0000000        
S   1
  1      0.6504050              1.0000000        
S   1
  1      0.2328250              1.0000000        
P   5
  1    663.0620100              0.0030820        
  2    157.0928100              0.0241650        
  3     50.2311000              0.1082230        
  4     18.6353450              0.2941920        
  5      7.4465370              0.6878620        
P   2
  1      7.4465370             -0.1214482        
  2      3.0956980              0.1632370        
P   1
  1      1.1064630              1.0000000        
P   1
  1      0.4156010              1.0000000        
P   1
  1      0.1454490              1.0000000        
D   1
  1      0.8500000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: K
data:
POTASSIUM
S   6
  1 182594.0000000              0.000227747      
  2  27369.0000000              0.00176640       
  3   6229.1700000              0.00919497       
  4   1764.5800000              0.03745510       
  5    577.0510000              0.12204500       
  6    210.2490000              0.29899000       
S   2
  1     82.6178000              0.4051470        
  2     33.2332000              0.2925320        
S   1
  1      8.1064900              1.0000000        
S   1
  1      3.3340300              1.0000000        
S   1
  1      0.8455440              1.0000000        
S   1
  1      0.3282160              1.0000000        
S   1
  1      0.0364035              1.0000000        
S   1
  1      0.0176463              1.0000000        
P   3
  1    891.0540000              0.00218429       
  2    211.0160000              0.0175891        
  3     67.6714000              0.0817775        
P   3
  1     25.2715000              0.2456560        
  2     10.1390000              0.4339840        
  3      4.2018600              0.3623770        
P   1
  1      1.6250700              1.0000000        
P   1
  1      0.6437700              1.0000000        
P   1
  1      0.2461300              1.0000000        
P   1
  1      0.0454400              1.0000000        
P   1
  1      0.0161600              1.0000000        
D   3
  1     13.3700000              0.0316016        
  2      3.4210000              0.1568790        
  3      1.0630000              0.3905820        
D   1
  1      0.2290000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Ca
data:
CALCIUM
S   6
  1 202699.0000000              0.000222964      
  2  30382.5000000              0.00172932       
  3   6915.0800000              0.00900226       
  4   1959.0200000              0.0366699        
  5    640.9360000              0.1194100        
  6    233.9770000              0.2918250        
S   2
  1     92.2892000              0.4044150        
  2     37.2545000              0.2963130        
S   1
  1      9.1319800              1.0000000        
S   1
  1      3.8177900              1.0000000        
S   1
  1      1.0493500              1.0000000        
S   1
  1      0.4286600              1.0000000        
S   1
  1      0.0628226              1.0000000        
S   1
  1      0.0260162              1.0000000        
P   3
  1   1019.7600000              0.00205986       
  2    241.5960000              0.01665010       
  3     77.6370000              0.07776460       
P   3
  1     29.1154000              0.2418060        
  2     11.7626000              0.4325780        
  3      4.9228900              0.3673250        
P   1
  1      1.9064500              1.0000000        
P   1
  1      0.7369000              1.0000000        
P   1
  1      0.2764200              1.0000000        
P   1
  1      0.0602700              1.0000000        
P   1
  1      0.0179100              1.0000000        
D   3
  1     15.0800000              0.0368947        
  2      3.9260000              0.1778200        
  3      1.2330000              0.4255130        
D   1
  1      0.2600000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Ga
data:
GALLIUM
S   6
  1 333800.0000000              0.00083805       
  2  50100.0000000              0.00624660       
  3  11510.0000000              0.03202800       
  4   3292.0000000              0.12709000       
  5   1089.0000000              0.39092000       
  6    401.0000000              0.54643000       
S   3
  1    401.0000000              0.1807800        
  2    159.3000000              0.6223900        
  3     67.5900000              0.2495300        
S   1
  1     24.8900000              1.0000000        
S   1
  1     10.6800000              1.0000000        
S   1
  1      3.3860000              1.0000000        
S   1
  1      1.3310000              1.0000000        
S   1
  1      0.1853000              1.0000000        
S   1
  1      0.0662100              1.0000000        
P   3
  1   2181.0000000              0.0225650        
  2    515.4000000              0.1836300        
  3    164.8000000              0.8598400        
P   3
  1     61.4000000              0.3434500        
  2     24.9800000              0.5056100        
  3     10.4400000              0.2622400        
P   3
  1     10.4400000              0.0641300        
  2      5.5890000              0.3788400        
  3      2.5170000              0.6166900        
P   1
  1      1.0530000              1.0000000        
P   1
  1      0.2915000              1.0000000        
P   1
  1      0.1210000              1.0000000        
P   1
  1      0.0399000              1.0000000        
D   4
  1     67.1400000              0.0309570        
  2     18.9400000              0.1748000        
  3      6.4260000              0.4434600        
  4      2.1900000              0.5670200        
D   1
  1      0.6725000              1.0000000        
D   1
  1      0.1690000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Ge
data:
GERMANIUM
S   6
  1 357500.0000000              0.00083898       
  2  53670.0000000              0.00626350       
  3  12300.0000000              0.03203600       
  4   3512.0000000              0.12751000       
  5   1161.0000000              0.39165000       
  6    428.0000000              0.54528000       
S   3
  1    428.0000000              0.1816000        
  2    170.0000000              0.6224800        
  3     72.0600000              0.2487200        
S   1
  1     26.6900000              1.0000000        
S   1
  1     11.5000000              1.0000000        
S   1
  1      3.7420000              1.0000000        
S   1
  1      1.4990000              1.0000000        
S   1
  1      0.2292000              1.0000000        
S   1
  1      0.0867500              1.0000000        
P   3
  1   2345.0000000              0.0225140        
  2    554.2000000              0.1833500        
  3    177.3000000              0.8600300        
P   3
  1     66.1300000              0.3430600        
  2     26.9000000              0.5065200        
  3     11.2600000              0.2614100        
P   3
  1     11.2600000              0.0672460        
  2      6.1160000              0.3723800        
  3      2.8190000              0.6176300        
P   1
  1      1.2110000              1.0000000        
P   1
  1      0.3568000              1.0000000        
P   1
  1      0.1621000              1.0000000        
P   1
  1      0.0608400              1.0000000        
D   4
  1     74.8400000              0.0303900        
  2     21.2300000              0.1731900        
  3      7.2970000              0.4409000        
  4      2.5490000              0.5653200        
D   1
  1      0.8165000              1.0000000        
D   1
  1      0.2280000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: As
data:
ARSENIC
S   6
  1 381200.0000000              0.00083327       
  2  57240.0000000              0.00621980       
  3  13110.0000000              0.03203000       
  4   3743.0000000              0.12729000       
  5   1238.0000000              0.39132000       
  6    456.3000000              0.54581000       
S   3
  1    456.3000000              0.1809700        
  2    181.4000000              0.6218000        
  3     77.0700000              0.2498800        
S   1
  1     28.5700000              1.0000000        
S   1
  1     12.3600000              1.0000000        
S   1
  1      4.1170000              1.0000000        
S   1
  1      1.6780000              1.0000000        
S   1
  1      0.2761000              1.0000000        
S   1
  1      0.1105000              1.0000000        
P   3
  1   2528.0000000              0.0222710        
  2    597.3000000              0.1819900        
  3    190.7000000              0.8613300        
P   3
  1     70.9600000              0.3433800        
  2     28.8900000              0.5059800        
  3     12.1300000              0.2612800        
P   3
  1     12.1300000              0.0685360        
  2      6.5330000              0.3828200        
  3      3.0280000              0.6059900        
P   1
  1      1.3440000              1.0000000        
P   1
  1      0.5823000              1.0000000        
P   1
  1      0.2558000              1.0000000        
P   1
  1      0.0865100              1.0000000        
D   4
  1     86.0500000              0.0279890        
  2     24.4900000              0.1650200        
  3      8.4420000              0.4373600        
  4      2.9810000              0.5725500        
D   1
  1      0.9790000              1.0000000        
D   1
  1      0.2640000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Se
data:
SELENIUM
S   6
  1 405400.0000000              0.0008310        
  2  60850.0000000              0.0062331        
  3  13910.0000000              0.0320710        
  4   3989.0000000              0.1263600        
  5   1324.0000000              0.3889900        
  6    487.0000000              0.5488800        
S   3
  1    487.0000000              0.1796300        
  2    193.2000000              0.6222700        
  3     82.1900000              0.2506700        
S   1
  1     30.5200000              1.0000000        
S   1
  1     13.2500000              1.0000000        
S   1
  1      4.5100000              1.0000000        
S   1
  1      1.8670000              1.0000000        
S   1
  1      0.3190000              1.0000000        
S   1
  1      0.1120000              1.0000000        
P   3
  1   2706.0000000              0.0221460        
  2    638.6000000              0.1818000        
  3    203.8000000              0.8615500        
P   3
  1     75.9600000              0.3424300        
  2     31.0200000              0.5054100        
  3     13.0500000              0.2623700        
P   3
  1     13.0500000              0.0701630        
  2      6.9860000              0.3841900        
  3      3.2340000              0.6036800        
P   1
  1      1.4750000              1.0000000        
P   1
  1      0.7275000              1.0000000        
P   1
  1      0.2869000              1.0000000        
P   1
  1      0.0967900              1.0000000        
D   4
  1     99.0100000              0.0255960        
  2     28.4100000              0.1545900        
  3      9.8630000              0.4287800        
  4      3.5140000              0.5862000        
D   1
  1      1.1710000              1.0000000        
D   1
  1      0.3050000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Br
data:
BROMINE
S   6
  1 439700.0000000              0.0008130        
  2  66030.0000000              0.0062850        
  3  15140.0000000              0.0319200        
  4   4317.0000000              0.1288000        
  5   1414.0000000              0.3946000        
  6    523.9000000              0.5413000        
S   3
  1    523.9000000              0.1831000        
  2    207.7000000              0.6176000        
  3     86.5400000              0.2538000        
S   1
  1     30.5200000              1.0000000        
S   1
  1     12.9800000              1.0000000        
S   1
  1      4.4120000              1.0000000        
S   1
  1      1.8620000              1.0000000        
S   1
  1      0.3932000              1.0000000        
S   1
  1      0.1400000              1.0000000        
P   3
  1   2957.0000000              0.0222600        
  2    700.3000000              0.1802000        
  3    224.6000000              0.8624000        
P   3
  1     82.5900000              0.3440000        
  2     33.1900000              0.5071000        
  3     14.2000000              0.2590000        
P   3
  1     14.2000000              0.0796500        
  2      7.4380000              0.3734000        
  3      3.5260000              0.6049000        
P   1
  1      1.5950000              1.0000000        
P   1
  1      0.8462000              1.0000000        
P   1
  1      0.3186000              1.0000000        
P   1
  1      0.1096000              1.0000000        
D   4
  1    134.8000000              0.0183100        
  2     36.3900000              0.1350000        
  3     12.1600000              0.4261000        
  4      4.3410000              0.6043000        
D   1
  1      1.5350000              1.0000000        
D   1
  1      0.4510000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: Kr
data:
KRYPTON
S   6
  1 456200.0000000              0.0008111        
  2  68460.0000000              0.0062552        
  3  15650.0000000              0.0320220        
  4   4500.0000000              0.1254600        
  5   1497.0000000              0.3866600        
  6    550.5000000              0.5518800        
S   3
  1    550.5000000              0.1771100        
  2    218.2000000              0.6224800        
  3     92.9700000              0.2527900        
S   1
  1     34.5900000              1.0000000        
S   1
  1     15.1200000              1.0000000        
S   1
  1      5.3460000              1.0000000        
S   1
  1      2.2730000              1.0000000        
S   1
  1      0.4841000              1.0000000        
S   1
  1      0.1849000              1.0000000        
P   3
  1   3074.0000000              0.0219980        
  2    725.7000000              0.1810200        
  3    231.5000000              0.8622300        
P   3
  1     86.4500000              0.3415500        
  2     35.5500000              0.5025500        
  3     15.1400000              0.2645300        
P   3
  1     15.1400000              0.0716700        
  2      8.0310000              0.3970800        
  3      3.7990000              0.5876200        
P   1
  1      1.8490000              1.0000000        
P   1
  1      0.8676000              1.0000000        
P   1
  1      0.3329000              1.0000000        
P   1
  1      0.1199000              1.0000000        
D   4
  1    122.5000000              0.0233770        
  2     35.3700000              0.1461000        
  3     12.3900000              0.4223000        
  4      4.4960000              0.5945200        
D   1
  1      1.5460000              1.0000000        
D   1
  1      0.3950000              1.0000000


name: 6-311G*
description: VTZP Valence Triple Zeta + Polarization on Nonhydrogen
elt: I
data:
IODINE
S   5
  1 444750.0000000              0.0008900        
  2  66127.0000000              0.0069400        
  3  14815.0000000              0.0360900        
  4   4144.9000000              0.1356800        
  5   1361.2000000              0.3387800        
S   2
  1    508.4400000              0.4365900        
  2    209.5900000              0.1837500        
S   1
  1     81.9590000              1.0000000        
S   1
  1     36.8050000              1.0000000        
S   1
  1     13.4950000              1.0000000        
S   1
  1      6.8859000              1.0000000        
S   1
  1      2.5520000              1.0000000        
S   1
  1      1.2088000              1.0000000        
S   1
  1      0.2734000              1.0000000        
S   1
  1      0.1009000              1.0000000        
P   4
  1   2953.6000000              0.0122100        
  2    712.6100000              0.0858700        
  3    236.7100000              0.2949300        
  4     92.6310000              0.4784900        
P   1
  1     39.7320000              1.0000000        
P   1
  1     17.2730000              1.0000000        
P   1
  1      7.9570000              1.0000000        
P   1
  1      3.1529000              1.0000000        
P   1
  1      1.3328000              1.0000000        
P   1
  1      0.4947000              1.0000000        
P   1
  1      0.2160000              1.0000000        
P   1
  1      0.0829300              1.0000000        
D   3
  1    261.9500000              0.0314400        
  2     76.7340000              0.1902800        
  3     27.5510000              0.4724700        
D   1
  1     10.6060000              1.0000000        
D   1
  1      3.4217000              1.0000000        
D   1
  1      1.1370000              1.0000000        
D   1
  1      0.3020000              1.0000000


name: 6-311G**
description: VTZP Valence Triple Zeta + Polarization on All Atoms
elt: H
data:
HYDROGEN
S   3
  1     33.8650000              0.0254938        
  2      5.0947900              0.1903730        
  3      1.1587900              0.8521610        
S   1
  1      0.3258400              1.0000000        
S   1
  1      0.1027410              1.0000000        
P   1
  1      0.7500000              1.0000000


name: 6-311G**
description: VTZP Valence Triple Zeta + Polarization on All Atoms
elt: He
data:
HELIUM
S   3
  1     98.1243000              0.0287452        
  2     14.7689000              0.2080610        
  3      3.3188300              0.8376350        
S   1
  1      0.8740470              1.0000000        
S   1
  1      0.2445640              1.0000000        
P   1
  1      0.7500000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: H
data:
HYDROGEN
S   3
  1     18.7311370              0.03349460       
  2      2.8253937              0.23472695       
  3      0.6401217              0.81375733       
S   1
  1      0.1612778              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Li
data:
LITHIUM
S   6
  1    642.4189200              0.0021426        
  2     96.7985150              0.0162089        
  3     22.0911210              0.0773156        
  4      6.2010703              0.2457860        
  5      1.9351177              0.4701890        
  6      0.6367358              0.3454708        
L   3
  1      2.3249184             -0.0350917              0.0089415        
  2      0.6324306             -0.1912328              0.1410095        
  3      0.0790534              1.0839878              0.9453637        
L   1
  1      0.0359620              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Be
data:
BERYLLIUM
S   6
  1   1264.5857000              0.0019448        
  2    189.9368100              0.0148351        
  3     43.1590890              0.0720906        
  4     12.0986630              0.2371542        
  5      3.8063232              0.4691987        
  6      1.2728903              0.3565202        
L   3
  1      3.1964631             -0.1126487              0.0559802        
  2      0.7478133             -0.2295064              0.2615506        
  3      0.2199663              1.1869167              0.7939723        
L   1
  1      0.0823099              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: B
data:
BORON
S   6
  1   2068.8823000              0.0018663        
  2    310.6495700              0.0142515        
  3     70.6830330              0.0695516        
  4     19.8610800              0.2325729        
  5      6.2993048              0.4670787        
  6      2.1270270              0.3634314        
L   3
  1      4.7279710             -0.1303938              0.0745976        
  2      1.1903377             -0.1307889              0.3078467        
  3      0.3594117              1.1309444              0.7434568        
L   1
  1      0.1267512              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: C
data:
CARBON
S   6
  1   3047.5249000              0.0018347        
  2    457.3695100              0.0140373        
  3    103.9486900              0.0688426        
  4     29.2101550              0.2321844        
  5      9.2866630              0.4679413        
  6      3.1639270              0.3623120        
L   3
  1      7.8682724             -0.1193324              0.0689991        
  2      1.8812885             -0.1608542              0.3164240        
  3      0.5442493              1.1434564              0.7443083        
L   1
  1      0.1687144              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: N
data:
NITROGEN
S   6
  1   4173.5110000              0.0018348        
  2    627.4579000              0.0139950        
  3    142.9021000              0.0685870        
  4     40.2343300              0.2322410        
  5     12.8202100              0.4690700        
  6      4.3904370              0.3604550        
L   3
  1     11.6263580             -0.1149610              0.0675800        
  2      2.7162800             -0.1691180              0.3239070        
  3      0.7722180              1.1458520              0.7408950        
L   1
  1      0.2120313              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: O
data:
OXYGEN
S   6
  1   5484.6717000              0.0018311        
  2    825.2349500              0.0139501        
  3    188.0469600              0.0684451        
  4     52.9645000              0.2327143        
  5     16.8975700              0.4701930        
  6      5.7996353              0.3585209        
L   3
  1     15.5396160             -0.1107775              0.0708743        
  2      3.5999336             -0.1480263              0.3397528        
  3      1.0137618              1.1307670              0.7271586        
L   1
  1      0.2700058              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: F
data:
FLUORINE
S   6
  1   7001.7130900              0.0018196169     
  2   1051.3660900              0.0139160796     
  3    239.2856900              0.0684053245     
  4     67.3974453              0.233185760      
  5     21.5199573              0.471267439      
  6      7.40310130             0.356618546      
L   3
  1     20.8479528             -0.108506975            0.0716287243     
  2      4.80830834            -0.146451658            0.3459121030     
  3      1.34406986             1.128688580            0.7224699570     
L   1
  1      0.358151393            1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ne
data:
NEON
S   6
  1   8425.8515300              0.0018843481     
  2   1268.5194000              0.0143368994     
  3    289.6214140              0.0701096233     
  4     81.8590040              0.2373732660     
  5     26.2515079              0.4730071260     
  6      9.09472051             0.3484012410     
L   3
  1     26.5321310             -0.107118287            0.0719095885     
  2      6.10175501            -0.146163821            0.3495133720     
  3      1.69627153             1.127773500            0.7199405120     
L   1
  1      0.44581870             1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Na
data:
SODIUM
S   6
  1   9993.2000000              0.0019377        
  2   1499.8900000              0.0148070        
  3    341.9510000              0.0727060        
  4     94.6797000              0.2526290        
  5     29.7345000              0.4932420        
  6     10.0063000              0.3131690        
L   6
  1    150.9630000             -0.0035421              0.0050017        
  2     35.5878000             -0.0439590              0.0355110        
  3     11.1683000             -0.1097521              0.1428250        
  4      3.9020100              0.1873980              0.3386200        
  5      1.3817700              0.6466990              0.4515790        
  6      0.4663820              0.3060580              0.2732710        
L   3
  1      0.4979660             -0.2485030             -0.0230230        
  2      0.0843530             -0.1317040              0.9503590        
  3      0.0666350              1.2335200              0.0598580        
L   1
  1      0.0259544              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Mg
data:
MAGNESIUM
S   6
  1  11722.8000000              0.0019778        
  2   1759.9300000              0.0151140        
  3    400.8460000              0.0739110        
  4    112.8070000              0.2491910        
  5     35.9997000              0.4879280        
  6     12.1828000              0.3196620        
L   6
  1    189.1800000             -0.0032372              0.0049281        
  2     45.2119000             -0.0410080              0.0349890        
  3     14.3563000             -0.1126000              0.1407250        
  4      5.1388600              0.1486330              0.3336420        
  5      1.9065200              0.6164970              0.4449400        
  6      0.7058870              0.3648290              0.2692540        
L   3
  1      0.9293400             -0.2122900             -0.0224190        
  2      0.2690350             -0.1079850              0.1922700        
  3      0.1173790              1.1758400              0.8461810        
L   1
  1      0.0421061              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Al
data:
ALUMINUM
S   6
  1  13983.1000000              0.00194267       
  2   2098.7500000              0.0148599        
  3    477.7050000              0.0728494        
  4    134.3600000              0.2468300        
  5     42.8709000              0.4872580        
  6     14.5189000              0.3234960        
L   6
  1    239.6680000             -0.00292619             0.00460285       
  2     57.4419000             -0.0374080              0.0331990        
  3     18.2859000             -0.1144870              0.1362820        
  4      6.5991400              0.1156350              0.3304760        
  5      2.4904900              0.6125950              0.4491460        
  6      0.9445400              0.3937990              0.2657040        
L   3
  1      1.2779000             -0.2276060             -0.0175130        
  2      0.3975900              0.00144583             0.2445330        
  3      0.1600950              1.0927900              0.8049340        
L   1
  1      0.0556577              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Si
data:
SILICON
S   6
  1  16115.9000000              0.00195948       
  2   2425.5800000              0.01492880       
  3    553.8670000              0.07284780       
  4    156.3400000              0.24613000       
  5     50.0683000              0.48591400       
  6     17.0178000              0.32500200       
L   6
  1    292.7180000             -0.00278094             0.00443826       
  2     69.8731000             -0.03571460             0.03266790       
  3     22.3363000             -0.11498500             0.13472100       
  4      8.1503900              0.09356340             0.32867800       
  5      3.1345800              0.60301700             0.44964000       
  6      1.2254300              0.41895900             0.26137200       
L   3
  1      1.7273800             -0.24463000            -0.01779510       
  2      0.5729220              0.00431572             0.25353900       
  3      0.2221920              1.09818000             0.80066900       
L   1
  1      0.0778369              1.00000000             1.00000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: P
data:
PHOSPHORUS
S   6
  1  19413.3000000              0.0018516        
  2   2909.4200000              0.0142062        
  3    661.3640000              0.0699995        
  4    185.7590000              0.2400790        
  5     59.1943000              0.4847620        
  6     20.0310000              0.3352000        
L   6
  1    339.4780000             -0.00278217             0.00456462       
  2     81.0101000             -0.0360499              0.03369360       
  3     25.8780000             -0.1166310              0.13975500       
  4      9.4522100              0.0968328              0.33936200       
  5      3.6656600              0.6144180              0.45092100       
  6      1.4674600              0.4037980              0.23858600       
L   3
  1      2.1562300             -0.2529230             -0.01776530       
  2      0.7489970              0.0328517              0.27405800       
  3      0.2831450              1.0812500              0.78542100       
L   1
  1      0.0998317              1.0000000              1.00000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: S
data:
SULFUR
S   6
  1  21917.1000000              0.0018690        
  2   3301.4900000              0.0142300        
  3    754.1460000              0.0696960        
  4    212.7110000              0.2384870        
  5     67.9896000              0.4833070        
  6     23.0515000              0.3380740        
L   6
  1    423.7350000             -0.0023767              0.0040610        
  2    100.7100000             -0.0316930              0.0306810        
  3     32.1599000             -0.1133170              0.1304520        
  4     11.8079000              0.0560900              0.3272050        
  5      4.6311000              0.5922550              0.4528510        
  6      1.8702500              0.4550060              0.2560420        
L   3
  1      2.6158400             -0.2503740             -0.0145110        
  2      0.9221670              0.0669570              0.3102630        
  3      0.3412870              1.0545100              0.7544830        
L   1
  1      0.1171670              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cl
data:
CHLORINE
S   6
  1  25180.1000000              0.0018330        
  2   3780.3500000              0.0140340        
  3    860.4740000              0.0690970        
  4    242.1450000              0.2374520        
  5     77.3349000              0.4830340        
  6     26.2470000              0.3398560        
L   6
  1    491.7650000             -0.0022974              0.0039894        
  2    116.9840000             -0.0307140              0.0303180        
  3     37.4153000             -0.1125280              0.1298800        
  4     13.7834000              0.0450160              0.3279510        
  5      5.4521500              0.5893530              0.4535270        
  6      2.2258800              0.4652060              0.2521540        
L   3
  1      3.1864900             -0.2518300             -0.0142990        
  2      1.1442700              0.0615890              0.3235720        
  3      0.4203770              1.0601800              0.7435070        
L   1
  1      0.1426570              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ar
data:
ARGON
S   6
  1  28348.3000000              0.00182526       
  2   4257.6200000              0.01396860       
  3    969.8570000              0.06870730       
  4    273.2630000              0.23620400       
  5     87.3695000              0.48221400       
  6     29.6867000              0.34204300       
L   6
  1    575.8910000             -0.00215972             0.00380665       
  2    136.8160000             -0.02907750             0.02923050       
  3     43.8098000             -0.11082700             0.12646700       
  4     16.2094000              0.02769990             0.32351000       
  5      6.4608400              0.57761300             0.45489600       
  6      2.6511400              0.48868800             0.25663000       
L   3
  1      3.8602800             -0.2555920             -0.01591970       
  2      1.4137300              0.0378066              0.32464600       
  3      0.5166460              1.0805600              0.74399000       
L   1
  1      0.1738880              1.0000000              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: K
data:
POTASSIUM
S   6
  1  31594.4200000              1.828010E-03     
  2   4744.3300000              1.399403E-02     
  3   1080.4190000              6.887129E-02     
  4    304.2338000              2.369760E-01     
  5     97.2458600              4.829040E-01     
  6     33.0249500              3.404795E-01     
L   6
  1    622.7625000             -2.502976E-03           4.094637E-03     
  2    147.8839000             -3.315550E-02           3.145199E-02     
  3     47.3273500             -1.226387E-01           1.351558E-01     
  4     17.5149500              5.353643E-02           3.390500E-01     
  5      6.9227220              6.193860E-01           4.629455E-01     
  6      2.7682770              4.345878E-01           2.242638E-01     
L   6
  1     11.8480200              1.277689E-02          -1.221377E-02     
  2      4.0792110              2.098767E-01          -6.900537E-03     
  3      1.7634810             -3.095274E-03           2.007466E-01     
  4      0.7889270             -5.593884E-01           4.281332E-01     
  5      0.3503870             -5.134760E-01           3.970156E-01     
  6      0.1463440             -6.598035E-02           1.104718E-01     
L   3
  1      0.7168010             -5.237772E-02           0.0316430        
  2      0.2337410             -2.798503E-01          -0.0404616        
  3      0.0386750              1.141547E+00           1.0120290        
L   1
  1      0.0165210              1.000000E+00           1.00000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ca
data:
CALCIUM
S   6
  1  35264.8600000              1.813501E-03     
  2   5295.5030000              1.388493E-02     
  3   1206.0200000              6.836162E-02     
  4    339.6839000              2.356188E-01     
  5    108.6264000              4.820639E-01     
  6     36.9210300              3.429819E-01     
L   6
  1    706.3096000              2.448225E-03           4.020371E-03     
  2    167.8187000              3.241504E-02           3.100601E-02     
  3     53.8255800              1.226219E-01           1.337279E-01     
  4     20.0163800             -4.316965E-02           3.367983E-01     
  5      7.9702790             -6.126995E-01           4.631281E-01     
  6      3.2120590             -4.487540E-01           2.257532E-01     
L   6
  1     14.1951800              1.084500E-02          -1.289621E-02     
  2      4.8808280              2.088333E-01          -1.025198E-02     
  3      2.1603900              3.150338E-02           1.959781E-01     
  4      0.9878990             -5.526518E-01           4.357933E-01     
  5      0.4495170             -5.437997E-01           3.996452E-01     
  6      0.1873870             -6.669342E-02           9.713636E-02     
L   3
  1      1.0322710             -4.439720E-02          -0.4298621        
  2      0.3811710             -3.284563E-01           0.006935829      
  3      0.0651310              1.163010E+00           0.9705933        
L   1
  1      0.0260100              1.000000E+00           1.00000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Sc
data:
SCANDIUM
S   6
  1  39088.9800000              1.803263E-03     
  2   5869.7920000              1.380769E-02     
  3   1336.9100000              6.800396E-02     
  4    376.6031000              2.347099E-01     
  5    120.4679000              4.815690E-01     
  6     40.9803200              3.445652E-01     
L   6
  1    786.2852000              2.451863E-03           4.039530E-03     
  2    186.8870000              3.259579E-02           3.122570E-02     
  3     60.0093500              1.238242E-01           1.349833E-01     
  4     22.2588300             -4.359890E-02           3.424793E-01     
  5      8.8851490             -6.177181E-01           4.623113E-01     
  6      3.6092110             -4.432823E-01           2.177524E-01     
L   6
  1     29.8435500             -2.586302E-03          -6.096652E-03     
  2      9.5423830              7.188424E-02          -2.628884E-02     
  3      4.0567900              2.503260E-01           5.091001E-02     
  4      1.7047030             -2.991003E-01           3.798097E-01     
  5      0.7062340             -7.446818E-01           5.170883E-01     
  6      0.2795360             -1.799776E-01           1.829772E-01     
L   3
  1      1.0656090              6.482978E-02          -0.2938440        
  2      0.4259330              3.253756E-01           0.09235323       
  3      0.0763200             -1.170806E+00           0.9847930        
L   1
  1      0.0295940              1.000000E+00           1.00000000       
D   3
  1     11.1470100              8.747672E-02     
  2      2.8210430              3.795635E-01     
  3      0.8196200              7.180393E-01     
D   1
  1      0.2214680              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Ti
data:
TITANIUM
S   6
  1  43152.9500000              1.791872E-03     
  2   6479.5710000              1.372392E-02     
  3   1475.6750000              6.762830E-02     
  4    415.6991000              2.337642E-01     
  5    133.0006000              4.810696E-01     
  6     45.2722200              3.462280E-01     
L   6
  1    874.6826000              2.431008E-03           4.017679E-03     
  2    207.9785000              3.233027E-02           3.113966E-02     
  3     66.8791800              1.242520E-01           1.349077E-01     
  4     24.8734700             -3.903905E-02           3.431672E-01     
  5      9.9684410             -6.171789E-01           4.625760E-01     
  6      4.0638260             -4.473097E-01           2.154603E-01     
L   6
  1     33.6436300             -2.940358E-03          -6.311620E-03     
  2     10.8756500              7.163103E-02          -2.697638E-02     
  3      4.6282250              2.528915E-01           5.316847E-02     
  4      1.9501260             -2.966401E-01           3.845549E-01     
  5      0.8094520             -7.432215E-01           5.127662E-01     
  6      0.3204740             -1.853520E-01           1.811135E-01     
L   3
  1      1.2241480              6.351465E-02          -0.2112070        
  2      0.4842630              3.151404E-01           0.07771998       
  3      0.0840960             -1.162595E+00           0.9898214        
L   1
  1      0.0320360              1.000000E+00           1.00000000       
D   3
  1     13.6908500              8.589418E-02     
  2      3.5131540              3.784671E-01     
  3      1.0404340              7.161239E-01     
D   1
  1      0.2869620              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: V
data:
VANADIUM
S   6
  1  47354.3300000              1.784513E-03     
  2   7110.7870000              1.366754E-02     
  3   1619.5910000              6.736122E-02     
  4    456.3379000              2.330552E-01     
  5    146.0606000              4.806316E-01     
  6     49.7579100              3.474802E-01     
L   6
  1    968.1484000              2.410599E-03           3.995005E-03     
  2    230.2821000              3.207243E-02           3.104061E-02     
  3     74.1459100              1.245942E-01           1.347747E-01     
  4     27.6410700             -3.482177E-02           3.437279E-01     
  5     11.1147500             -6.167374E-01           4.628759E-01     
  6      4.5431130             -4.509844E-01           2.135547E-01     
L   6
  1     37.6405000             -3.233199E-03          -6.494056E-03     
  2     12.2823800              7.130744E-02          -2.753453E-02     
  3      5.2333660              2.543820E-01           5.516284E-02     
  4      2.2089500             -2.933887E-01           3.879672E-01     
  5      0.9178800             -7.415695E-01           5.090258E-01     
  6      0.3634120             -1.909410E-01           1.803840E-01     
L   3
  1      1.3927810              6.139703E-02          -0.1891265        
  2      0.5439130              3.061130E-01           0.08005453       
  3      0.0914760             -1.154890E+00           0.9877399        
L   1
  1      0.0343120              1.000000E+00           1.00000000       
D   3
  1     16.0502500              8.599899E-02     
  2      4.1600630              3.802996E-01     
  3      1.2432650              7.127659E-01     
D   1
  1      0.3442770              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Cr
data:
CHROMIUM
S   6
  1  51789.8100000              1.776182E-03     
  2   7776.8490000              1.360476E-02     
  3   1771.3850000              6.706925E-02     
  4    499.1588000              2.323104E-01     
  5    159.7982000              4.802410E-01     
  6     54.4702100              3.487653E-01     
L   6
  1   1064.3280000              2.399669E-03           3.986997E-03     
  2    253.2138000              3.194886E-02           3.104662E-02     
  3     81.6092400              1.250868E-01           1.350518E-01     
  4     30.4819300             -3.221866E-02           3.448865E-01     
  5     12.2943900             -6.172284E-01           4.628571E-01     
  6      5.0377220             -4.525936E-01           2.110426E-01     
L   6
  1     41.5629100             -3.454216E-03          -6.722497E-03     
  2     13.6762700              7.218428E-02          -2.806471E-02     
  3      5.8443900              2.544820E-01           5.820028E-02     
  4      2.4716090             -2.934534E-01           3.916988E-01     
  5      1.0283080             -7.385455E-01           5.047823E-01     
  6      0.4072500             -1.947157E-01           1.790290E-01     
L   3
  1      1.5714640              0.05892219            -0.1930100        
  2      0.6055800              0.2976055              0.0960562        
  3      0.0985610             -1.1475060              0.9817609        
L   1
  1      0.0364590              1.000000E+00           1.0000000        
D   3
  1     18.4193000              8.650816E-02     
  2      4.8126610              3.826699E-01     
  3      1.4464470              7.093772E-01     
D   1
  1      0.4004130              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Mn
data:
MANGANESE
S   6
  1  56347.1400000              1.771580E-03     
  2   8460.9430000              1.357081E-02     
  3   1927.3250000              6.690605E-02     
  4    543.2343000              2.318541E-01     
  5    173.9905000              4.799046E-01     
  6     59.3600500              3.495737E-01     
L   6
  1   1165.4120000              2.388751E-03           3.977318E-03     
  2    277.3276000              3.181708E-02           3.103112E-02     
  3     89.4727800              1.254670E-01           1.351894E-01     
  4     33.4825600             -2.955431E-02           3.457387E-01     
  5     13.5403700             -6.175160E-01           4.629205E-01     
  6      5.5579720             -4.544458E-01           2.090592E-01     
L   6
  1     45.8353200             -3.665856E-03          -6.887578E-03     
  2     15.1877700              7.231971E-02          -2.846816E-02     
  3      6.5007100              2.544486E-01           6.031832E-02     
  4      2.7515830             -2.910380E-01           3.938961E-01     
  5      1.1454040             -7.359860E-01           5.013769E-01     
  6      0.4536870             -1.997617E-01           1.792264E-01     
L   3
  1      1.7579990              0.05628572            -0.5035024        
  2      0.6670220              0.2897491              0.2345011        
  3      0.1051290             -1.1406530              0.9141257        
L   1
  1      0.0384180              1.000000E+00           1.00000000       
D   3
  1     20.9435500              8.672702E-02     
  2      5.5104860              3.841883E-01     
  3      1.6650380              7.069071E-01     
D   1
  1      0.4617330              1.0000000


name: 6-31G
description: VDZ Valence Double Zeta: 2 Funct.'s/Valence AO
elt: Fe
data:
IRON
S   6
  1  61132.6200000              1.766111E-03     
  2   9179.3420000              1.353038E-02     
  3   2090.8570000              6.673128E-02     
  4    589.2479000              2.314823E-01     
  5    188.7543000              4.797058E-01     
  6     64.4462900              3.501976E-01     
L   6
  1   1259.9800000              2.438014E-03           4.028019E-03     
  2    299.8761000              3.224048E-02           3.144647E-02     
  3     96.8491700              1.265724E-01           1.368317E-01     
  4     36.3102000             -3.139902E-02           3.487236E-01     
  5     14.7299600             -6.207593E-01           4.617931E-01     
  6      6.0660750             -4.502914E-01           2.043058E-01     
L   6
  1     50.4348500             -3.873256E-03          -7.017128E-03     
  2     16.8392900              7.196598E-02          -2.877660E-02     
  3      7.1920860              2.556591E-01           6.181383E-02     
  4      3.0534200             -2.882837E-01           3.954946E-01     
  5      1.2736430             -7.342822E-01           4.989059E-01     
  6      0.5040910             -2.049353E-01           1.791251E-01     
L   3
  1      1.9503160              0.05694869            -0.4593796        
  2      0.7367210              0.2882915              0.2852139        
  3      0.1141770             -1.1381590              0.9076485        
L   1
  1      0.0411480              1.000000E+00           1.00000000       
D   3
  1     23.1499400              8.876935E-02     
  2      6.1223680              3.896319E-01     
  3      1.8466010              7.014816E-01     
D   1
  1      0.5043610              1.0000000


