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2020-02-04 19:04:36 +01:00
!----------------------------------------------------------------------
! Basis Set Exchange
! Version 2.1.0+44.g1191679.dirty
! https://www.basissetexchange.org
!----------------------------------------------------------------------
! Basis set: def2-QZVPPD
! Description: def2-QZVPPD
! Role: orbital
! Version: 1 (Data from Turbomole 7.3)
!----------------------------------------------------------------------
$DATA
HYDROGEN
S 4
1 190.6916900 0.70815167E-03
2 28.6055320 0.54678827E-02
3 6.5095943 0.27966605E-01
4 1.8412455 0.10764538
S 1
1 0.59853725 1.0000000
S 1
1 0.21397624 1.0000000
S 1
1 0.80316286E-01 1.0000000
P 1
1 2.29200000 1.0000000
P 1
1 0.83800000 1.0000000
P 1
1 0.29200000 1.0000000
P 1
1 0.84063199228E-01 1.0000000
D 1
1 2.06200000 1.0000000
D 1
1 0.66200000 1.0000000
F 1
1 1.39700000 1.0000000
HELIUM
S 5
1 1144.6470809 0.35861578618E-03
2 171.64596667 0.27725434466E-02
3 39.066056254 0.14241892216E-01
4 11.051401989 0.55457352277E-01
5 3.5725574473 0.16170511810
S 1
1 1.2429415962 .33177883833
S 1
1 0.44807668730 .42014033068
S 1
1 0.16411579128 .18652273014
P 1
1 5.99400000 1.0000000
P 1
1 1.74500000 1.0000000
P 1
1 0.56000000 1.0000000
P 1
1 0.16298923122 1.0000000
D 1
1 4.29900000 1.0000000
D 1
1 1.22300000 1.0000000
F 1
1 2.68000000 1.0000000
LITHIUM
S 9
1 14853.9770850 0.42711388815E-04
2 2225.2236477 0.33235310800E-03
3 504.88739008 0.17518436649E-02
4 142.45847548 0.73477995850E-02
5 46.315599580 0.25899837683E-01
6 16.655335474 0.76670682431E-01
7 6.4331186199 0.18276075765
8 2.6027043858 0.32655434038
9 1.0897245405 0.37000429828
S 2
1 4.4236595971 0.11120987921
2 1.2356394990 0.79987335862
S 1
1 0.46067470602 1.0000000
S 1
1 0.96617166955E-01 1.0000000
S 1
1 0.45915452296E-01 1.0000000
S 1
1 0.21140048730E-01 1.0000000
P 3
1 3.2605109206 0.86504749023E-02
2 0.65003043115 0.47614123736E-01
3 0.16941671073 0.21001138000
P 1
1 3.3270000 1.0000000
P 1
1 0.55732343767E-01 1.0000000
P 1
1 0.20489959241E-01 1.0000000
D 1
1 0.2300000 1.0000000
D 1
1 0.0757000 1.0000000
F 1
1 0.1350000 1.0000000
BERYLLIUM
S 8
1 29646.7044070 0.37943320869E-04
2 4428.7614354 0.29605352634E-03
3 1005.4701332 0.15572477356E-02
4 284.15339578 0.65323195769E-02
5 92.504356461 0.23116861005E-01
6 33.311016058 0.69458515249E-01
7 12.911553314 0.17014371331
8 5.2665497361 0.31682711374
S 2
1 22.995386380 0.81791122747E-01
2 6.6236354176 0.80000038023
S 1
1 2.2289595003 1.0000000
S 1
1 0.95302433451 1.0000000
S 1
1 0.24651602436 1.0000000
S 1
1 0.10153895315 1.0000000
S 1
1 0.41551374604E-01 1.0000000
P 4
1 14.099789445 0.38508871145E-02
2 3.1803188482 0.24152380771E-01
3 0.90489220496 0.97926925156E-01
4 0.30411585508 0.29470380030
P 1
1 6.4000000 1.0000000
P 1
1 0.11302606657 1.0000000
P 1
1 0.42831733691E-01 1.0000000
D 1
1 0.3600000 1.0000000
D 1
1 0.0900000 1.0000000
F 1
1 0.2900000 1.0000000
BORON
S 8
1 46447.6670560 0.38388681014E-04
2 6957.6889042 0.29836770197E-03
3 1583.4428403 0.15645478806E-02
4 448.46601009 0.65476770742E-02
5 146.28639262 0.23139008388E-01
6 52.784386084 0.69615799357E-01
7 20.519396170 0.17119636876
8 8.4185659258 0.31913191837
S 2
1 36.510018312 0.78990617244E-01
2 10.541854005 0.78926384265
S 1
1 3.6004091387 1.0000000
S 1
1 1.5617023749 1.0000000
S 1
1 0.44997370775 1.0000000
S 1
1 0.18075230237 1.0000000
S 1
1 0.71596696319E-01 1.0000000
S 1
1 0.29941402533E-01 1.0000000
P 5
1 72.240462760 0.86539170411E-03
2 16.807707208 0.68762067365E-02
3 5.2259410747 0.30976687148E-01
4 1.8508350671 0.10432357913
5 0.72206782663 0.26164137577
P 1
1 0.29491018056 1.0000000
P 1
1 0.12201141839 1.0000000
P 1
1 0.49865393625E-01 1.0000000
D 1
1 1.11000000 1.0000000
D 1
1 0.40200000 1.0000000
D 1
1 0.14500000 1.0000000
D 1
1 0.50896593879E-01 1.0000000
F 1
1 0.88200000 1.0000000
F 1
1 0.31100000 1.0000000
G 1
1 0.67300000 1.0000000
CARBON
S 8
1 67025.0710290 0.38736308501E-04
2 10039.9865380 0.30107917575E-03
3 2284.9316911 0.15787918095E-02
4 647.14122130 0.66087087195E-02
5 211.09472335 0.23367123250E-01
6 76.177643862 0.70420716898E-01
7 29.633839163 0.17360344953
8 12.187785081 0.32292305648
S 2
1 53.026006299 0.74897404492E-01
2 15.258502776 0.76136220983
S 1
1 5.2403957464 1.0000000
S 1
1 2.2905022379 1.0000000
S 1
1 0.69673283006 1.0000000
S 1
1 0.27599337363 1.0000000
S 1
1 0.10739884389 1.0000000
S 1
1 0.44981404899E-01 1.0000000
P 5
1 105.12555082 0.84647553844E-03
2 24.884461066 0.66274038534E-02
3 7.8637230826 0.30120390419E-01
4 2.8407001835 0.99951435476E-01
5 1.1227137335 0.23826299282
P 1
1 0.46050725555 1.0000000
P 1
1 0.18937530913 1.0000000
P 1
1 0.75983791611E-01 1.0000000
D 1
1 1.84800000 1.0000000
D 1
1 0.64900000 1.0000000
D 1
1 0.22800000 1.0000000
D 1
1 0.76889830417E-01 1.0000000
F 1
1 1.41900000 1.0000000
F 1
1 0.48500000 1.0000000
G 1
1 1.01100000 1.0000000
NITROGEN
S 8
1 90726.8892100 0.39257887368E-04
2 13590.5288010 0.30513316455E-03
3 3092.9883781 0.16000560446E-02
4 875.99876362 0.66982937306E-02
5 285.74469982 0.23690078765E-01
6 103.11913417 0.71455405268E-01
7 40.128556777 0.17632774876
8 16.528095704 0.32677592815
S 2
1 69.390960983 0.80052094386E-01
2 20.428200596 0.78268063538
S 1
1 7.1292587972 1.0000000
S 1
1 3.1324304893 1.0000000
S 1
1 0.98755778723 1.0000000
S 1
1 0.38765721307 1.0000000
S 1
1 0.14909883075 1.0000000
S 1
1 0.62151630318E-01 1.0000000
P 5
1 150.05742670 -0.86216165986E-03
2 35.491599483 -0.68571273236E-02
3 11.247864223 -0.31795688855E-01
4 4.0900305195 -0.10537396822
5 1.6220573146 -0.24519708041
P 1
1 0.66442261530 1.0000000
P 1
1 0.27099770070 1.0000000
P 1
1 0.10688749984 1.0000000
D 1
1 2.83700000 1.0000000
D 1
1 0.96800000 1.0000000
D 1
1 0.33500000 1.0000000
D 1
1 0.10825280010 1.0000000
F 1
1 2.02700000 1.0000000
F 1
1 0.68500000 1.0000000
G 1
1 1.42700000 1.0000000
OXYGEN
S 8
1 116506.4690800 0.40383857939E-04
2 17504.3497240 0.31255139004E-03
3 3993.4513230 0.16341473495E-02
4 1133.0063186 0.68283224757E-02
5 369.99569594 0.24124410221E-01
6 133.62074349 0.72730206154E-01
7 52.035643649 0.17934429892
8 21.461939313 0.33059588895
S 2
1 89.835051252 0.96468652996E-01
2 26.428010844 0.94117481120
S 1
1 9.2822824649 1.0000000
S 1
1 4.0947728533 1.0000000
S 1
1 1.3255349078 1.0000000
S 1
1 0.51877230787 1.0000000
S 1
1 0.19772676454 1.0000000
S 1
1 0.69638535104E-01 1.0000000
P 5
1 191.15255810 0.25115697705E-02
2 45.233356739 0.20039240864E-01
3 14.353465922 0.93609064762E-01
4 5.2422371832 0.30618127124
5 2.0792418599 0.67810501439
P 1
1 0.84282371424 1.0000000
P 1
1 0.33617694891 1.0000000
P 1
1 0.12863997974 1.0000000
P 1
1 0.43598162776E-01 1.0000000
D 1
1 3.77500000 1.0000000
D 1
1 1.30000000 1.0000000
D 1
1 0.44400000 1.0000000
D 1
1 0.12546378695 1.0000000
F 1
1 2.66600000 1.0000000
F 1
1 0.85900000 1.0000000
G 1
1 1.84600000 1.0000000
FLUORINE
S 8
1 132535.9734500 0.47387482743E-04
2 19758.1125880 0.37070120897E-03
3 4485.1996947 0.19450784713E-02
4 1273.8151020 0.80573291994E-02
5 418.93831236 0.27992880781E-01
6 152.55721985 0.82735120175E-01
7 59.821524823 0.19854169012
8 24.819076932 0.34860632233
S 2
1 100.74446673 0.10505068816
2 30.103728290 0.94068472434
S 1
1 10.814283272 1.0000000
S 1
1 4.8172886770 1.0000000
S 1
1 1.6559334213 1.0000000
S 1
1 0.64893519582 1.0000000
S 1
1 0.24778104545 1.0000000
S 1
1 0.87626236800E-01 1.0000000
P 5
1 240.96654114 0.30389933451E-02
2 57.020699781 0.24357738582E-01
3 18.126952120 0.11442925768
4 6.6457404621 0.37064659853
5 2.6375722892 0.79791551766
P 1
1 1.0638217200 1.0000000
P 1
1 0.41932562750 1.0000000
P 1
1 0.15747588299 1.0000000
P 1
1 0.46772400332E-01 1.0000000
D 1
1 5.01400000 1.0000000
D 1
1 1.72500000 1.0000000
D 1
1 0.58600000 1.0000000
D 1
1 0.15967986245 1.0000000
F 1
1 3.56200000 1.0000000
F 1
1 1.14800000 1.0000000
G 1
1 2.37600000 1.0000000
NEON
S 8
1 160676.2795500 0.47387482743E-04
2 23953.1950390 0.37070120897E-03
3 5437.5063711 0.19450784713E-02
4 1544.2741024 0.80573291994E-02
5 507.88814269 0.27992880781E-01
6 184.94847750 0.82735120175E-01
7 72.522952039 0.19854169012
8 30.088713575 0.34860632233
S 2
1 120.68434940 0.10400597014
2 36.074294857 0.91999988986
S 1
1 13.052091210 1.0000000
S 1
1 5.7974783353 1.0000000
S 1
1 2.0478626895 1.0000000
S 1
1 0.80214571994 1.0000000
S 1
1 0.30548672205 1.0000000
S 1
1 0.10621243030 1.0000000
P 6
1 498.43397466 0.43118261050E-03
2 118.14109217 0.36206397703E-02
3 38.032529735 0.18245344081E-01
4 14.183731950 0.65133035572E-01
5 5.7864190721 0.16708915089
6 2.4599622160 0.29268019613
P 1
1 1.0421999498 1.0000000
P 1
1 0.42987748916 1.0000000
P 1
1 0.16889708453 1.0000000
P 1
1 0.47169461232E-01 1.0000000
D 1
1 6.47100000 1.0000000
D 1
1 2.21300000 1.0000000
D 1
1 0.74700000 1.0000000
D 1
1 0.19790459442 1.0000000
F 1
1 4.65700000 1.0000000
F 1
1 1.52400000 1.0000000
G 1
1 2.98300000 1.0000000
SODIUM
S 10
1 379852.2008100 0.20671384468E-04
2 56886.0063780 0.16070466617E-03
3 12942.7018380 0.84462905848E-03
4 3664.3017904 0.35519026029E-02
5 1194.7417499 0.12754034468E-01
6 430.98192917 0.39895462742E-01
7 167.83169424 0.10720154498
8 69.306669040 0.23339516913
9 29.951170886 0.36333077287
10 13.380791097 0.30544770974
S 3
1 121.74011283 0.36142427284E-01
2 37.044143387 0.28820961687
3 13.995422624 0.79337384869
S 1
1 5.9827797428 1.0000000
S 1
1 2.4830455118 1.0000000
S 1
1 1.0452506187 1.0000000
S 1
1 0.43875640383 1.0000000
S 1
1 0.65595633185E-01 1.0000000
S 1
1 0.30561925072E-01 1.0000000
S 1
1 0.15509064018E-01 1.0000000
P 8
1 690.77627017 0.37478518415E-03
2 163.82806121 0.31775441030E-02
3 52.876460769 0.16333581338E-01
4 19.812270493 0.59754902585E-01
5 8.1320378784 0.15879328812
6 3.4969068377 0.29049363260
7 1.5117244146 0.36368131139
8 0.64479294912 0.28195867334
P 1
1 0.26145823312 1.0000000
P 1
1 0.11704726116 1.0000000
P 1
1 0.40494747666E-01 1.0000000
P 1
1 0.15666707355E-01 1.0000000
D 1
1 5.3000000 1.0000000
D 1
1 1.5900000 1.0000000
D 1
1 0.2300000 1.0000000
D 1
1 0.0757000 1.0000000
F 1
1 4.2700000 1.0000000
F 1
1 0.1350000 1.0000000
MAGNESIUM
S 10
1 605967.7875300 0.14430176617E-04
2 90569.0946920 0.11249871807E-03
3 20574.2528440 0.59264972450E-03
4 5818.6284865 0.24988770424E-02
5 1895.6296075 0.90230775141E-02
6 683.45941021 0.28579919806E-01
7 266.18219762 0.79064453923E-01
8 110.11220010 0.18269337814
9 47.777041234 0.32157193967
10 21.542166149 0.35028259389
S 3
1 174.12136378 0.22931111278E-01
2 53.484972498 0.19151777552
3 20.500213307 0.61155711055
S 1
1 9.8056826922 1.0000000
S 1
1 3.5402989348 1.0000000
S 1
1 1.5450850046 1.0000000
S 1
1 0.66540195432 1.0000000
S 1
1 0.14355439071 1.0000000
S 1
1 0.66624673468E-01 1.0000000
S 1
1 0.29772648266E-01 1.0000000
P 8
1 893.20460829 0.34958267428E-03
2 211.78258286 0.29811890111E-02
3 68.443200537 0.15517845758E-01
4 25.727265349 0.57578659557E-01
5 10.606634281 0.15610307853
6 4.5934126484 0.29230912580
7 2.0100469807 0.37219024072
8 0.87384841536 0.27578088891
P 1
1 0.35615076666 1.0000000
P 1
1 0.18995954356 1.0000000
P 1
1 0.74580135669E-01 1.0000000
P 1
1 0.29221641309E-01 1.0000000
D 1
1 6.9300000 1.0000000
D 1
1 2.1000000 1.0000000
D 1
1 0.6500000 1.0000000
D 1
1 0.2000000 1.0000000
D 1
1 0.0520000 1.0000000
F 1
1 5.6000000 1.0000000
F 1
1 0.1600000 1.0000000
ALUMINUM
S 10
1 754550.7826500 0.13421335886E-04
2 112999.3892200 0.10433210786E-03
3 25715.8317590 0.54841772080E-03
4 7283.6030283 0.23089081391E-02
5 2376.0008796 0.83309974593E-02
6 857.65468087 0.26417963653E-01
7 334.38922598 0.73443646426E-01
8 138.48504731 0.17184039139
9 60.150368808 0.31041980030
10 27.127610860 0.35669190596
S 3
1 225.36500065 0.21522039783E-01
2 69.341968124 0.18531780493
3 26.619335712 0.63533181245
S 1
1 12.349420671 1.0000000
S 1
1 4.5878785994 1.0000000
S 1
1 2.0571338103 1.0000000
S 1
1 0.90864549395 1.0000000
S 1
1 0.24226988038 1.0000000
S 1
1 0.11248136869 1.0000000
S 1
1 0.48156492817E-01 1.0000000
S 1
1 0.21134849794E-01 1.0000000
P 8
1 1489.6119522 0.20177122443E-03
2 353.01399267 0.17508109203E-02
3 114.40764069 0.94424704664E-02
4 43.312186111 0.36868004006E-01
5 18.027322216 0.10892874007
6 7.9675432403 0.23265901004
7 3.6090399541 0.34643587076
8 1.6456081630 0.33440809866
P 2
1 34.731187489 0.17823073020E-01
2 1.2553083630 -0.59991263926
P 1
1 0.73635534282 1.0000000
P 1
1 0.24686465559 1.0000000
P 1
1 0.94821971828E-01 1.0000000
P 1
1 0.36214165654E-01 1.0000000
D 1
1 1.9700000000 1.0000000
D 1
1 0.4370000000 1.0000000
D 1
1 0.1950000000 1.0000000
D 1
1 0.0800000000 1.0000000
D 1
1 0.30664004967E-01 1.0000000
F 1
1 0.4010000000 1.0000000
F 1
1 0.1540000000 1.0000000
G 1
1 0.3570000000 1.0000000
SILICON
S 10
1 918070.6956500 0.12658787192E-04
2 137485.2538600 0.98408387461E-04
3 31287.7727140 0.51731398244E-03
4 8861.6105697 0.21785441933E-02
5 2890.6943156 0.78656853716E-02
6 1043.4063979 0.24987553674E-01
7 406.80160276 0.69761818844E-01
8 168.48360207 0.16473362733
9 73.185628823 0.30285602647
10 32.998485420 0.36007260439
S 3
1 278.78751325 0.20185463814E-01
2 85.910228722 0.17720406747
3 32.992604031 0.63587860906
S 1
1 15.033693254 1.0000000
S 1
1 5.7257514773 1.0000000
S 1
1 2.6146521029 1.0000000
S 1
1 1.1757833152 1.0000000
S 1
1 0.35432330868 1.0000000
S 1
1 0.16248335806 1.0000000
S 1
1 0.68332457181E-01 1.0000000
S 1
1 0.30521078871E-01 1.0000000
P 8
1 1775.8850516 0.20186971126E-03
2 420.83786849 0.17544314655E-02
3 136.42290243 0.95039532290E-02
4 51.700991737 0.37325741590E-01
5 21.559456002 0.11085396329
6 9.5559200095 0.23756407046
7 4.3529819473 0.35295783750
8 2.0096964381 0.32885931947
P 2
1 46.418153780 0.25858819154E-01
2 1.9076417796 -0.59874865899
P 1
1 0.92337221587 1.0000000
P 1
1 0.34515720370 1.0000000
P 1
1 0.13656834761 1.0000000
P 1
1 0.52987060586E-01 1.0000000
D 1
1 2.64500000 1.0000000
D 1
1 0.608000000 1.0000000
D 1
1 0.272000000 1.0000000
D 1
1 0.113000000 1.0000000
D 1
1 0.44018904228E-01 1.0000000
F 1
1 0.541000000 1.0000000
F 1
1 0.212000000 1.0000000
G 1
1 0.461000000 1.0000000
PHOSPHORUS
S 10
1 1090561.7138000 0.12142449664E-04
2 163316.3946100 0.94395292614E-04
3 37166.6074510 0.49622262177E-03
4 10526.8809450 0.20900040747E-02
5 3433.9976028 0.75489230025E-02
6 1239.5360480 0.24010423937E-01
7 483.27456199 0.67231473697E-01
8 200.16911586 0.15978669881
9 86.960394829 0.29735906782
10 39.211283369 0.36187171850
S 3
1 336.75883662 0.19154721050E-01
2 103.72179793 0.17134079100
3 39.771861240 0.63689655985
S 1
1 17.888612952 1.0000000
S 1
1 6.9644556879 1.0000000
S 1
1 3.2198092087 1.0000000
S 1
1 1.4669943979 1.0000000
S 1
1 0.47765437532 1.0000000
S 1
1 0.21637789241 1.0000000
S 1
1 0.90235894336E-01 1.0000000
S 1
1 0.40836372978E-01 1.0000000
P 8
1 2019.6711374 0.21359172406E-03
2 478.60125090 0.18568771399E-02
3 155.14942504 0.10070690115E-01
4 58.816356575 0.39605153679E-01
5 24.544512785 0.11736067844
6 10.883571061 0.24950540642
7 4.9624791285 0.36421287984
8 2.3002912343 0.31764127123
P 2
1 59.371345016 0.39432918004
2 3.0694590986 -6.3522960431
P 1
1 1.0634401739 1.0000000
P 1
1 0.45022152161 1.0000000
P 1
1 0.18267271344 1.0000000
P 1
1 0.71610333771E-01 1.0000000
D 1
1 3.34300000 1.0000000
D 1
1 0.807000000 1.0000000
D 1
1 0.365000000 1.0000000
D 1
1 0.154000000 1.0000000
D 1
1 0.59687731846E-01 1.0000000
F 1
1 0.703000000 1.0000000
F 1
1 0.280000000 1.0000000
G 1
1 0.597000000 1.0000000
SULFUR
S 10
1 1273410.9023000 0.11767088246E-04
2 190697.8300700 0.91478610166E-04
3 43397.8853300 0.48090078640E-03
4 12291.8096770 0.20257193592E-02
5 4009.7420824 0.73190096406E-02
6 1447.3531030 0.23300499900E-01
7 564.30102913 0.65386213610E-01
8 233.74506243 0.15614449910
9 101.56402814 0.29318563787
10 45.805907187 0.36287914289
S 3
1 394.27281503 0.18753305081E-01
2 121.72249591 0.16870726663
3 46.754125963 0.63806830653
S 1
1 20.923008254 1.0000000
S 1
1 8.2685567800 1.0000000
S 1
1 3.8629345671 1.0000000
S 1
1 1.7794684781 1.0000000
S 1
1 0.61064260103 1.0000000
S 1
1 0.27412269445 1.0000000
S 1
1 0.11325939107 1.0000000
S 1
1 0.44392624881E-01 1.0000000
P 8
1 2189.8930459 0.23912552864E-03
2 518.94596592 0.20772032158E-02
3 168.19560151 0.11242420571E-01
4 63.745282788 0.44069933941E-01
5 26.597033077 0.12918778608
6 11.774251449 0.26910820167
7 5.3534379024 0.37855928620
8 2.4701911802 0.29692134655
P 2
1 82.120288349 -0.39420318847E-01
2 4.9523532869 0.64048403090
P 1
1 1.0828262029 1.0000000
P 1
1 0.49271277356 1.0000000
P 1
1 0.20483450942 1.0000000
P 1
1 0.80743615716E-01 1.0000000
P 1
1 0.25661157833E-01 1.0000000
D 1
1 4.15900000 1.0000000
D 1
1 1.01900000 1.0000000
D 1
1 0.464000000 1.0000000
D 1
1 0.194000000 1.0000000
D 1
1 0.67889829366E-01 1.0000000
F 1
1 0.869000000 1.0000000
F 1
1 0.335000000 1.0000000
G 1
1 0.683000000 1.0000000
CHLORINE
S 10
1 1467459.0095000 0.11478257194E-04
2 219756.1643300 0.89234299775E-04
3 50010.7703010 0.46911086186E-03
4 14164.8239180 0.19762446133E-02
5 4620.7465525 0.71419937783E-02
6 1667.8991635 0.22753219445E-01
7 650.29199265 0.63959782953E-01
8 269.38037376 0.15331059238
9 117.06752106 0.28986952417
10 52.811766843 0.36348071452
S 3
1 461.42769988 0.18019457578E-01
2 142.12665355 0.16489442314
3 54.437838768 0.63891587584
S 1
1 24.160770219 1.0000000
S 1
1 9.7083540306 1.0000000
S 1
1 4.5640696733 1.0000000
S 1
1 2.1194744832 1.0000000
S 1
1 0.75722365394 1.0000000
S 1
1 0.33747224597 1.0000000
S 1
1 0.13860775149 1.0000000
S 1
1 0.54234565513E-01 1.0000000
P 8
1 2501.9457890 0.24242618410E-03
2 592.88059285 0.21079961749E-02
3 192.18089186 0.11432693869E-01
4 72.875710488 0.44956698060E-01
5 30.436358370 0.13197476145
6 13.490178902 0.27493639225
7 6.1478071413 0.38347236372
8 2.8450944820 0.28871943885
P 2
1 105.39397936 -0.34311760144E-01
2 6.7369738513 0.64060818902
P 1
1 1.2421095772 1.0000000
P 1
1 0.55669714254 1.0000000
P 1
1 0.23387801464 1.0000000
P 1
1 0.93164490890E-01 1.0000000
P 1
1 0.27256146018E-01 1.0000000
D 1
1 5.19100000 1.0000000
D 1
1 1.27600000 1.0000000
D 1
1 0.583000000 1.0000000
D 1
1 0.243000000 1.0000000
D 1
1 0.83456538402E-01 1.0000000
F 1
1 1.08900000 1.0000000
F 1
1 0.423000000 1.0000000
G 1
1 0.827000000 1.0000000
ARGON
S 10
1 1673421.9494000 0.11245990413E-04
2 250601.7537300 0.87428115798E-04
3 57030.9121200 0.45961641275E-03
4 16153.3039150 0.19363890742E-02
5 5269.4109288 0.69994046497E-02
6 1902.0315541 0.22312068196E-01
7 741.57677159 0.62808077697E-01
8 307.20901906 0.15101140997
9 133.52786203 0.28713661177
10 60.253381291 0.36385490107
S 3
1 522.02426206 0.18071323116E-01
2 161.51290469 0.16449219884
3 62.126369433 0.63897334899
S 1
1 27.590930012 1.0000000
S 1
1 11.175528881 1.0000000
S 1
1 5.2959065137 1.0000000
S 1
1 2.4782798895 1.0000000
S 1
1 0.91262095059 1.0000000
S 1
1 0.40426067549 1.0000000
S 1
1 0.16562886306 1.0000000
S 1
1 0.65129364729E-01 1.0000000
P 8
1 2868.4504581 0.24010435121E-03
2 679.71869590 0.20904788665E-02
3 220.36758824 0.11369316839E-01
4 83.620439734 0.44901977398E-01
5 34.964322657 0.13237156770
6 15.525131784 0.27709277600
7 7.0992979806 0.38613979646
8 3.3021336602 0.28492925372
P 2
1 128.78765667 -0.30509457751E-01
2 8.4357867977 0.64101621070
P 1
1 1.4618661855 1.0000000
P 1
1 0.64658010096 1.0000000
P 1
1 0.27229295755 1.0000000
P 1
1 0.10905182449 1.0000000
P 1
1 0.30101149684E-01 1.0000000
D 1
1 6.31500000 1.0000000
D 1
1 1.56200000 1.0000000
D 1
1 0.715000000 1.0000000
D 1
1 0.297000000 1.0000000
D 1
1 0.10105028218 1.0000000
F 1
1 1.32500000 1.0000000
F 1
1 0.543000000 1.0000000
G 1
1 1.00700000 1.0000000
POTASSIUM
S 11
1 2022075.1391000 0.10144874011E-04
2 303044.6556800 0.78783500963E-04
3 69013.9384900 0.41380919674E-03
4 19559.2446150 0.17427571893E-02
5 6383.8934901 0.63004086126E-02
6 2305.3502858 0.20125347032E-01
7 899.14418101 0.56966060520E-01
8 372.59500133 0.13882654093
9 161.97635247 0.27132285414
10 73.085553853 0.36383620662
11 33.595644762 0.24724464776
S 4
1 685.49855365 0.44367463797E-02
2 211.66163373 0.42502718169E-01
3 80.851405131 0.18467742018
4 35.108667236 0.29353173891
S 1
1 14.409437283 1.0000000
S 1
1 6.8697147262 1.0000000
S 1
1 3.2121883687 1.0000000
S 1
1 1.2610484365 1.0000000
S 1
1 0.61438946301 1.0000000
S 1
1 0.27264370973 1.0000000
S 1
1 0.77173005207E-01 1.0000000
S 1
1 0.40918397569E-01 1.0000000
S 1
1 0.17055762425E-01 1.0000000
P 9
1 3469.6649718 0.21340225970E-03
2 822.02356107 0.18637844836E-02
3 266.58406636 0.10211431546E-01
4 101.28048161 0.40799604728E-01
5 42.429490761 0.12257473393
6 18.912083912 0.26405833679
7 8.7017779030 0.38227164575
8 4.0854567599 0.29998812383
9 1.8667286060 0.78007265591E-01
P 5
1 27.544639057 -0.58222994163E-02
2 9.2098893609 -0.26787531329E-01
3 1.7232877425 0.30666847665
4 0.77969303735 0.66927944165
5 0.34379047862 0.60376468615
P 1
1 0.14346681918 1.0000000
P 1
1 0.68000000000E-01 1.0000000
P 1
1 0.32000000000E-01 1.0000000
P 1
1 0.15300000000E-01 1.0000000
D 1
1 1.7000000 1.0000000
D 1
1 0.5100000 1.0000000
D 1
1 0.1800000 1.0000000
D 1
1 0.0540000 1.0000000
F 1
1 2.3700000 1.0000000
F 1
1 0.7900000 1.0000000
F 1
1 0.0900000 1.0000000
CALCIUM
S 11
1 2433075.4304000 0.91625196182E-05
2 364160.4301500 0.71271617974E-04
3 82898.7476370 0.37433706369E-03
4 23499.7305400 0.15762862250E-02
5 7671.2245985 0.57026102580E-02
6 2770.2330687 0.18255738108E-01
7 1080.6807550 0.51906421035E-01
8 448.04894531 0.12791238579
9 194.92007727 0.25586635231
10 88.039793338 0.36028678275
11 40.645696719 0.26838462020
S 4
1 779.53331918 -0.18403005509E-01
2 241.18856300 -0.17649440544
3 92.403869324 -0.77662799584
4 39.786090342 -1.3352155444
S 1
1 18.195864278 1.0000000
S 1
1 8.3321457067 1.0000000
S 1
1 3.9190196209 1.0000000
S 1
1 1.6667099493 1.0000000
S 1
1 0.80891084908 1.0000000
S 1
1 0.36174199934 1.0000000
S 1
1 0.82379874526E-01 1.0000000
S 1
1 0.47947864375E-01 1.0000000
S 1
1 0.22308112408E-01 1.0000000
P 9
1 4064.2232796 0.19780891021E-03
2 962.91550624 0.17307465902E-02
3 312.34501046 0.95298721105E-02
4 118.76056036 0.38387459783E-01
5 49.816153133 0.11679256218
6 22.259679401 0.25637225097
7 10.286094124 0.37986193747
8 4.8606982416 0.30805760637
9 2.2525682942 0.85755999942E-01
P 5
1 31.467555443 -0.42441487483E-02
2 10.657589056 -0.19579425947E-01
3 2.0505555426 0.21237507422
4 0.94362089228 0.46277871121
5 0.42709067504 0.39177495728
P 1
1 0.17788187209 1.0000000
P 1
1 0.86000000000E-01 1.0000000
P 1
1 0.41500000000E-01 1.0000000
P 1
1 0.20000000000E-01 1.0000000
D 3
1 16.924012098 0.35543971560E-01
2 4.4655403330 0.18133698335
3 1.4347576200 0.48002060116
D 1
1 0.46552376784 1.0000000
D 1
1 0.14097711082 1.0000000
D 1
1 0.41467009281E-01 1.0000000
F 1
1 2.6500000000 1.0000000
F 1
1 0.7940000000 1.0000000
F 1
1 0.1300000 1.0000000
SCANDIUM
S 11
1 2855231.1264000 0.84862794535E-05
2 427433.3422100 0.65998092974E-04
3 97233.2185450 0.34740968058E-03
4 27496.2228460 0.14694099525E-02
5 8948.7324409 0.53410667286E-02
6 3221.0397292 0.17200652511E-01
7 1252.0534077 0.49287065332E-01
8 517.26093376 0.12273534550
9 224.33127242 0.24910183844
10 101.10551671 0.35884366997
11 46.684957855 0.27782811319
S 4
1 947.75965484 0.36123019249E-02
2 293.07262846 0.35616224567E-01
3 111.70230657 0.16664064248
4 47.756215212 0.32531051399
S 1
1 21.121984009 1.0000000
S 1
1 9.7765922198 1.0000000
S 1
1 4.5982699340 1.0000000
S 1
1 1.9928487767 1.0000000
S 1
1 0.95939954457 1.0000000
S 1
1 0.42566790070 1.0000000
S 1
1 0.98132196006E-01 1.0000000
S 1
1 0.56894222237E-01 1.0000000
S 1
1 0.25369907195E-01 1.0000000
P 9
1 4611.4680242 0.19180655992E-03
2 1092.4666458 0.16801897753E-02
3 354.41923265 0.92763338425E-02
4 134.83390286 0.37537202735E-01
5 56.610873926 0.11493045217
6 25.336605518 0.25446811084
7 11.741313238 0.37993352765
8 5.5697268625 0.30948776388
9 2.5949954062 0.86972259257E-01
P 5
1 35.951198081 -0.55780446917E-02
2 12.301020232 -0.25933825208E-01
3 2.3876557755 0.27489094204
4 1.1031823600 0.59208047142
5 0.50008479496 0.49113471853
P 1
1 0.20796508799 1.0000000
P 1
1 0.10100000000 1.0000000
P 1
1 0.48000000000E-01 1.0000000
P 1
1 0.23000000000E-01 1.0000000
D 5
1 73.531179748 0.22506354976E-02
2 21.764759639 0.16377610133E-01
3 7.9233701690 0.63330446952E-01
4 3.1847889778 0.17056208548
5 1.3427790019 0.30119020299
D 1
1 0.56149574983 1.0000000
D 1
1 0.22764073650 1.0000000
D 1
1 0.85211221793E-01 1.0000000
D 1
1 0.35E-01 1.0000000
F 1
1 1.4810000 1.0000000
F 1
1 0.3450000 1.0000000
F 1
1 0.1100000 1.0000000
G 1
1 0.5310000 1.0000000
G 1
1 0.1330000 1.0000000
TITANIUM
S 11
1 3070548.8651000 0.86954016630E-05
2 460777.8864300 0.67452737727E-04
3 104901.2288900 0.35477293028E-03
4 29695.8611990 0.14977525588E-02
5 9678.8892688 0.54309912055E-02
6 3490.1877912 0.17439360524E-01
7 1359.2217621 0.49835634640E-01
8 562.42721208 0.12379633943
9 244.22296250 0.25057490943
10 110.16668710 0.35934609007
11 50.881903357 0.27594242664
S 4
1 965.95430789 0.41773927781E-02
2 299.27072059 0.40277148567E-01
3 114.83772939 0.17898686817
4 49.477578954 0.31783043543
S 1
1 22.982839977 1.0000000
S 1
1 10.518305037 1.0000000
S 1
1 4.9774390567 1.0000000
S 1
1 2.1339846838 1.0000000
S 1
1 1.0342457284 1.0000000
S 1
1 0.46199774995 1.0000000
S 1
1 0.10621264194 1.0000000
S 1
1 0.54340347374E-01 1.0000000
S 1
1 0.25110217385E-01 1.0000000
P 9
1 5169.6755427 0.18802523596E-03
2 1225.0961638 0.16473458826E-02
3 397.60051934 0.91104554321E-02
4 151.36154684 0.36987450926E-01
5 63.613321773 0.11376329624
6 28.514560307 0.25345208574
7 13.248003298 0.38019402704
8 6.3048807760 0.30989136346
9 2.9493525821 0.87418944007E-01
P 5
1 40.738772213 -0.73233793267E-02
2 14.062358461 -0.34282591082E-01
3 2.7460680961 0.35655009250
4 1.2713688141 0.76112035427
5 0.57610015545 0.62716743237
P 1
1 0.23981820724 1.0000000
P 1
1 0.11000000000 1.0000000
P 1
1 0.50000000000E-01 1.0000000
P 1
1 0.23000000000E-01 1.0000000
D 5