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qp2/data/basis/pv7z

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!----------------------------------------------------------------------
! Basis Set Exchange
! Version 2.1.0+44.g1191679.dirty
! https://www.basissetexchange.org
!----------------------------------------------------------------------
! Basis set: pV7Z
! Description: pV7Z
! Role: orbital
! Version: 0 (Data from the original Basis Set Exchange)
!----------------------------------------------------------------------
$DATA
HYDROGEN
S 14
1 2762.5161400 0.0000220
2 1211.8584400 0.0000060
3 531.6171200 0.0000944
4 233.2093860 0.0001794
5 102.3041130 0.0005845
6 44.8786889 0.0015591
7 19.6873484 0.0043883
8 8.63643073 0.0120863
9 3.78862274 0.0325303
10 1.66199008 0.0840580
11 0.72908052 0.1934247
12 0.31983248 0.3510641
13 0.14030386 0.3587822
14 0.06154839 0.1060899
S 1
1 3.78862274 1.0000000
S 1
1 1.66199008 1.0000000
S 1
1 0.72908052 1.0000000
S 1
1 0.31983248 1.0000000
S 1
1 0.14030386 1.0000000
S 1
1 0.06154839 1.0000000
P 1
1 8.1536480 1.0000000
P 1
1 3.8622750 1.0000000
P 1
1 1.8295080 1.0000000
P 1
1 0.8666140 1.0000000
P 1
1 0.4105030 1.0000000
P 1
1 0.1944500 1.0000000
D 1
1 6.0348330 1.0000000
D 1
1 3.0569580 1.0000000
D 1
1 1.5485090 1.0000000
D 1
1 0.7844010 1.0000000
D 1
1 0.3973400 1.0000000
F 1
1 5.8947400 1.0000000
F 1
1 2.9029400 1.0000000
F 1
1 1.4295900 1.0000000
F 1
1 0.7040200 1.0000000
G 1
1 4.6226740 1.0000000
G 1
1 2.1711260 1.0000000
G 1
1 1.0197100 1.0000000
H 1
1 4.2237060 1.0000000
H 1
1 1.7050600 1.0000000
I 1
1 3.4140000 1.0000000
CARBON
S 18
1 949028.8000000 0.0000014
2 142083.0000000 0.0000110
3 32332.4700000 0.0000578
4 9158.1170000 0.0002444
5 2987.9090000 0.0008910
6 1078.7880000 0.0029040
7 420.8308000 0.0086310
8 174.6003000 0.0235290
9 76.1829200 0.0581610
10 34.6358800 0.1266240
11 16.2707600 0.2304650
12 7.8554790 0.3192970
13 3.8821720 0.2742950
14 1.9283340 0.1022520
15 0.8358060 0.0078620
16 0.3862910 0.0000068
17 0.1768600 0.0003690
18 0.0802520 -0.0000124
S 18
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5 2987.9090000 -0.0001900
6 1078.7880000 -0.0006200
7 420.8308000 -0.0018550
8 174.6003000 -0.0050920
9 76.1829200 -0.0129160
10 34.6358800 -0.0292300
11 16.2707600 -0.0584140
12 7.8554790 -0.0966550
13 3.8821720 -0.1260640
14 1.9283340 -0.0617220
15 0.8358060 0.1888280
16 0.3862910 0.4461160
17 0.1768600 0.4113350
18 0.0802520 0.1065520
S 1
1 3.8821720 1.0000000
S 1
1 1.9283340 1.0000000
S 1
1 0.8358060 1.0000000
S 1
1 0.3862910 1.0000000
S 1
1 0.1768600 1.0000000
S 1
1 0.0802520 1.0000000
P 12
1 765.4553000 0.0000272
2 180.8628000 0.0002410
3 58.7144100 0.0013570
4 22.4162500 0.0056200
5 9.4062140 0.0182670
6 4.1871980 0.0500190
7 1.9558760 0.1164080
8 0.9453360 0.2144660
9 0.4627630 0.3011680
10 0.2267960 0.3080450
11 0.1105920 0.1884750
12 0.0524000 0.0396220
P 1
1 1.9558760 1.0000000
P 1
1 0.9453360 1.0000000
P 1
1 0.4627630 1.0000000
P 1
1 0.2267960 1.0000000
P 1
1 0.1105920 1.0000000
P 1
1 0.0524000 1.0000000
D 1
1 8.0028000 1.0000000
D 1
1 3.6663000 1.0000000
D 1
1 1.6796000 1.0000000
D 1
1 0.7695000 1.0000000
D 1
1 0.3525000 1.0000000
D 1
1 0.1615000 1.0000000
F 1
1 3.5134000 1.0000000
F 1
1 1.8214000 1.0000000
F 1
1 0.9443000 1.0000000
F 1
1 0.4896000 1.0000000
F 1
1 0.2538000 1.0000000
G 1
1 3.0363000 1.0000000
G 1
1 1.6713000 1.0000000
G 1
1 0.9200000 1.0000000
G 1
1 0.5064000 1.0000000
H 1
1 1.8273000 1.0000000
H 1
1 0.8999000 1.0000000
H 1
1 0.4432000 1.0000000
I 1
1 3.2802000 1.0000000
I 1
1 0.6777000 1.0000000
J 1
1 1.9560000 1.0000000
NITROGEN
S 18
1 1296296.0000000 0.0000014
2 194068.6000000 0.0000110
3 44160.5700000 0.0000580
4 12507.7200000 0.0002450
5 4080.4760000 0.0008930
6 1473.1400000 0.0029130
7 574.6066000 0.0086640
8 238.3700000 0.0236350
9 103.9936000 0.0585180
10 47.2794400 0.1277287
11 22.2187100 0.2328737
12 10.7356900 0.3211170
13 5.3088560 0.2713167
14 2.6391770 0.0985308
15 1.1657640 0.0078886
16 0.5370910 0.0003125
17 0.2449040 0.0003640
18 0.1102710 0.0000727
S 18
1 1296296.0000000 -0.00000031
2 194068.6000000 -0.00000243
3 44160.5700000 -0.00001279
4 12507.7200000 -0.00005399
5 4080.4760000 -0.00019730
6 1473.1400000 -0.00064320
7 574.6066000 -0.00192640
8 238.3700000 -0.00529480
9 103.9936000 -0.01345880
10 47.2794400 -0.03061290
11 22.2187100 -0.06151130
12 10.7356900 -0.10200550
13 5.3088560 -0.12950140
14 2.6391770 -0.05370320
15 1.1657640 0.20297650
16 0.5370910 0.44857470
17 0.2449040 0.40031386
18 0.1102710 0.10245292
S 1
1 5.3088560 1.0000000
S 1
1 2.6391770 1.0000000
S 1
1 1.1657640 1.0000000
S 1
1 0.5370910 1.0000000
S 1
1 0.2449040 1.0000000
S 1
1 0.1102710 1.0000000
P 12
1 1094.9600000 0.0000276
2 258.6611000 0.0002450
3 83.8525500 0.0013920
4 31.9622500 0.0058590
5 13.4112100 0.0194130
6 5.9854710 0.0535998
7 2.8036300 0.1231956
8 1.3557360 0.2215690
9 0.6623960 0.3024095
10 0.3229120 0.3009864
11 0.1559210 0.1817918
12 0.0728200 0.0387420
P 1
1 2.8036300 1.0000000
P 1
1 1.3557360 1.0000000
P 1
1 0.6623960 1.0000000
P 1
1 0.3229120 1.0000000
P 1
1 0.1559210 1.0000000
P 1
1 0.0728200 1.0000000
D 1
1 8.5914298 1.0000000
D 1
1 4.0335351 1.0000000
D 1
1 1.8936785 1.0000000
D 1
1 0.8890509 1.0000000
D 1
1 0.4173948 1.0000000
D 1
1 0.1959600 1.0000000
F 1
1 5.7389002 1.0000000
F 1
1 2.7724156 1.0000000
F 1
1 1.3393312 1.0000000
F 1
1 0.6470199 1.0000000
F 1
1 0.3125700 1.0000000
G 1
1 5.5368024 1.0000000
G 1
1 2.5872908 1.0000000
G 1
1 1.2090144 1.0000000
G 1
1 0.5649600 1.0000000
H 1
1 4.2181288 1.0000000
H 1
1 2.0871494 1.0000000
H 1
1 1.0327300 1.0000000
I 1
1 3.4500000 1.0000000
I 1
1 1.5800000 1.0000000
J 1
1 2.3790000 1.0000000
OXYGEN
S 18
1 1678789.0000000 0.0000014
2 251388.2000000 0.0000112
3 57213.7300000 0.0000589
4 16207.4400000 0.0002490
5 5288.2760000 0.0009070
6 1909.4780000 0.0029570
7 744.9231000 0.0087910
8 309.0755000 0.0239800
9 134.8645000 0.0593810
10 61.3312900 0.1296500
11 28.8379600 0.2360640
12 13.9450400 0.3229210
13 6.8990770 0.2673950
14 3.4315770 0.0938440
15 1.5398400 0.0075330
16 0.7097510 0.0006320
17 0.3230470 0.0003560
18 0.1442220 0.0000330
S 18
1 1678789.0000000 -0.0000003
2 251388.2000000 -0.0000025
3 57213.7300000 -0.0000134
4 16207.4400000 -0.0000560
5 5288.2760000 -0.0002060
6 1909.4780000 -0.0006720
7 744.9231000 -0.0020130
8 309.0755000 -0.0055350
9 134.8645000 -0.0140790
10 61.3312900 -0.0321130
11 28.8379600 -0.0646760
12 13.9450400 -0.1071540
13 6.8990770 -0.1324380
14 3.4315770 -0.0456550
15 1.5398400 0.2183840
16 0.7097510 0.4533790
17 0.3230470 0.3873530
18 0.1442220 0.0958660
S 1
1 6.8990770 1.0000000
S 1
1 3.4315770 1.0000000
S 1
1 1.5398400 1.0000000
S 1
1 0.7097510 1.0000000
S 1
1 0.3230470 1.0000000
S 1
1 0.1442220 1.0000000
P 12
1 1349.0590000 0.0000323
2 319.4569000 0.0002860
3 103.7804000 0.0016160
4 39.6282100 0.0067850
5 16.6613700 0.0224990
6 7.4641660 0.0616740
7 3.5093250 0.1368450
8 1.6956800 0.2324860
9 0.8227420 0.2998210
10 0.3957330 0.2882440
11 0.1876440 0.1745550
12 0.0858410 0.0387270
P 1
1 3.5093250 1.0000000
P 1
1 1.6956800 1.0000000
P 1
1 0.8227420 1.0000000
P 1
1 0.3957330 1.0000000
P 1
1 0.1876440 1.0000000
P 1
1 0.0858410 1.0000000
D 1
1 10.0642930 1.0000000
D 1
1 4.8432594 1.0000000
D 1
1 2.3307312 1.0000000
D 1
1 1.1216223 1.0000000
D 1
1 0.5397605 1.0000000
D 1
1 0.2597500 1.0000000
F 1
1 6.9117087 1.0000000
F 1
1 3.4199449 1.0000000
F 1
1 1.6922043 1.0000000
F 1
1 0.8373104 1.0000000
F 1
1 0.4143050 1.0000000
G 1
1 7.2379949 1.0000000
G 1
1 3.4157598 1.0000000
G 1
1 1.6119678 1.0000000
G 1
1 0.7607210 1.0000000
H 1
1 5.7331092 1.0000000
H 1
1 2.5824816 1.0000000
H 1
1 1.1632800 1.0000000
I 1
1 4.8130000 1.0000000
I 1
1 2.0780000 1.0000000
J 1
1 3.1230000 1.0000000
FLUORINE
S 18
1 2115112.0000000 0.0000015
2 316699.7000000 0.0000113
3 72075.7100000 0.0000595
4 20416.8300000 0.0002514
5 6661.4580000 0.0009160
6 2405.1880000 0.0029860
7 938.2595000 0.0088819
8 389.2710000 0.0242321
9 169.8499000 0.0600301
10 77.2436700 0.1311355
11 36.3287400 0.2385632
12 17.5738700 0.3243075
13 8.6935300 0.2643763
14 4.3217690 0.0902843
15 1.9595200 0.0072583
16 0.9031850 0.0008288
17 0.4104050 0.0003496
18 0.1820240 0.0000495
S 18
1 2115112.0000000 -0.00000034
2 316699.7000000 -0.00000262
3 72075.7100000 -0.00001378
4 20416.8300000 -0.00005817
5 6661.4580000 -0.00021242
6 2405.1880000 -0.00069281
7 938.2595000 -0.00207460
8 389.2710000 -0.00570974
9 169.8499000 -0.01453560
10 77.2436700 -0.03323500
11 36.3287400 -0.06706620
12 17.5738700 -0.11098400
13 8.6935300 -0.13414569
14 4.3217690 -0.03874090
15 1.9595200 0.22972655
16 0.9031850 0.45572753
17 0.4104050 0.37782222
18 0.1820240 0.09134515
S 1
1 8.6935300 1.0000000
S 1
1 4.3217690 1.0000000
S 1
1 1.9595200 1.0000000
S 1
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S 1
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S 1
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P 12
1 1687.7180000 0.0000346
2 399.6517000 0.0003058
3 129.8267000 0.0017313
4 49.5782600 0.0072975
5 20.8619300 0.0243126
6 9.3655640 0.0664341
7 4.4099770 0.1445175
8 2.1283760 0.2383867
9 1.0282880 0.2985330
10 0.4907570 0.2811414
11 0.2300730 0.1699781
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P 1
1 4.4099770 1.0000000
P 1
1 2.1283760 1.0000000
P 1
1 1.0282880 1.0000000
P 1
1 0.4907570 1.0000000
P 1
1 0.2300730 1.0000000
P 1
1 0.1037660 1.0000000
D 1
1 12.6344950 1.0000000
D 1
1 6.1124792 1.0000000
D 1
1 2.9571743 1.0000000
D 1
1 1.4306600 1.0000000
D 1
1 0.6921432 1.0000000
D 1
1 0.3348540 1.0000000
F 1
1 11.6443240 1.0000000
F 1
1 5.5714469 1.0000000
F 1
1 2.6657641 1.0000000
F 1
1 1.2754852 1.0000000
F 1
1 0.6102800 1.0000000
G 1
1 8.2863953 1.0000000
G 1
1 3.9105216 1.0000000
G 1
1 1.8454562 1.0000000
G 1
1 0.8709090 1.0000000
H 1
1 7.7626969 1.0000000
H 1
1 3.4810300 1.0000000
H 1
1 1.5610000 1.0000000
I 1
1 5.5300000 1.0000000
I 1
1 2.1600000 1.0000000
J 1
1 4.2560000 1.0000000
NEON
S 18
1 2636740.0000000 0.00000144
2 394695.0000000 0.00001122
3 89814.2000000 0.00005899
4 25439.5000000 0.00024948
5 8292.4800000 0.00091034
6 2991.7700000 0.00297099
7 1166.5800000 0.00883634
8 483.9270000 0.02412806
9 211.0490000 0.05988851
10 95.9684000 0.13097415
11 45.1784000 0.23835621
12 21.8859000 0.32418282
13 10.8323000 0.26452052
14 5.3801400 0.09049215
15 2.4363700 0.00744055
16 1.1192500 0.00092098
17 0.5066970 0.00036701
18 0.2234500 0.00005493
S 18
1 2636740.0000000 -0.00000034
2 394695.0000000 -0.00000263
3 89814.2000000 -0.00001386
4 25439.5000000 -0.00005857
5 8292.4800000 -0.00021420
6 2991.7700000 -0.00069920
7 1166.5800000 -0.00209449
8 483.9270000 -0.00576925
9 211.0490000 -0.01472218
10 95.9684000 -0.03372066
11 45.1784000 -0.06818732
12 21.8859000 -0.11289702
13 10.8323000 -0.13557407
14 5.3801400 -0.03559771
15 2.4363700 0.23754291
16 1.1192500 0.45834479
17 0.5066970 0.37096215
18 0.2234500 0.08766775
S 1
1 10.8323000 1.0000000
S 1
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S 1
1 2.4363700 1.0000000
S 1
1 1.1192500 1.0000000
S 1
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S 1
1 0.2234500 1.0000000
P 12
1 2081.8400000 0.00003590
2 494.1240000 0.00031653
3 160.7080000 0.00179215
4 61.4172000 0.00757934
5 25.8676000 0.02539568
6 11.6199000 0.06951943
7 5.4635300 0.15008739
8 2.6257400 0.24380085
9 1.2610600 0.29919932
10 0.5977780 0.27603799
11 0.2781360 0.16464216
12 0.1243620 0.03732871
P 1
1 5.4635300 1.0000000
P 1
1 2.6257400 1.0000000
P 1
1 1.2610600 1.0000000
P 1
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P 1
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P 1
1 0.1243620 1.0000000
D 1
1 16.2700000 1.0000000
D 1
1 7.8088200 1.0000000
D 1
1 3.7478600 1.0000000
D 1
1 1.7987900 1.0000000
D 1
1 0.8633360 1.0000000
D 1
1 0.4143600 1.0000000
F 1
1 17.0078000 1.0000000
F 1
1 7.9602800 1.0000000
F 1
1 3.7256900 1.0000000
F 1
1 1.7437600 1.0000000
F 1
1 0.8161400 1.0000000
G 1
1 10.1051000 1.0000000
G 1
1 4.8284800 1.0000000
G 1
1 2.3071800 1.0000000
G 1
1 1.1024300 1.0000000
H 1
1 9.8549000 1.0000000
H 1
1 4.4595900 1.0000000
H 1
1 2.0180800 1.0000000
I 1
1 7.2823700 1.0000000
I 1
1 2.9259400 1.0000000
J 1
1 5.2560000 1.0000000
SULFUR
S 27
1 7010036.0000000 0.14393981E-5
2 3489316.1000000 -0.84034208E-6
3 1736842.2000000 0.48692049E-5
4 864530.7300000 0.32375410E-5
5 430328.8900000 0.16768271E-4
6 214200.5400000 0.31007451E-4
7 106620.4800000 0.82993952E-4
8 53071.4180000 0.18998198E-3
9 26416.8330000 0.46151388E-3
10 13149.2450000 0.10945308E-2
11 6545.1692000 0.26089891E-2
12 3257.9239000 0.61757438E-2
13 1621.6645000 0.14458895E-1
14 807.1998400 0.33174850E-1
15 401.7918600 0.72811640E-1
16 199.9959500 0.147223973
17 99.54999800 0.254144316
18 49.55201500 0.324750529
19 24.66501500 0.230874675
20 12.27726000 0.059430194
21 6.111129800 0.38523020E-2
22 3.041876500 0.75199422E-3
23 1.514124700 0.96173329E-4
24 0.753670820 -0.48480439E-4
25 0.375147250 0.59147870E-5
26 0.186733320 -0.16352333E-4
27 0.092948394 0.15469134E-5
S 27
1 7010036.0000000 0.39743053E-6
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8 53071.4180000 0.52621485E-4
9 26416.8330000 0.12734765E-3
10 13149.2450000 0.30346017E-3
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13 1621.6645000 0.40541165E-2
14 807.1998400 0.94756820E-2
15 401.7918600 0.21425437E-1
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26 0.186733320 0.472993143E-3
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S 27
1 7010036.0000000 -0.11553338E-6
2 3489316.1000000 0.67978120E-7
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4 864530.7300000 -0.25512491E-6
5 430328.8900000 -0.13547393E-5
6 214200.5400000 -0.24646622E-5
7 106620.4800000 -0.67031950E-5
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9 26416.8330000 -0.37253152E-4
10 13149.2450000 -0.87520661E-4
11 6545.1692000 -0.21103236E-3
12 3257.9239000 -0.49767312E-3
13 1621.6645000 -0.11840931E-2
14 807.1998400 -0.27474376E-2
15 401.7918600 -0.62804034E-2
16 199.9959500 -0.13515810E-1
17 99.54999800 -0.26818906E-1
18 49.55201500 -0.44279856E-1
19 24.66501500 -0.47655137E-1
20 12.27726000 0.69191566E-2
21 6.111129800 0.1275718473
22 3.041876500 0.2882489253
23 1.514124700 0.2327209700
24 0.753670820 -0.1794604833
25 0.375147250 -0.5183858403
26 0.186733320 -0.4285380863
27 0.092948394 -0.1254947129
S 1
1 3.041876500 1.0000000
S 1
1 1.514124700 1.0000000
S 1
1 0.753670820 1.0000000
S 1
1 0.375147250 1.0000000
S 1
1 0.186733320 1.0000000
S 1
1 0.092948394 1.0000000
P 18
1 9780.0262000 0.14400789E-4
2 4800.6372000 0.14765406E-4
3 2356.4475000 0.10011551E-3
4 1156.6891000 0.29000274E-3
5 567.7740000 0.10415811E-2
6 278.6983300 0.34037782E-2
7 136.8022500 0.10841169E-1
8 67.15094300 0.31942317E-1
9 32.96180500 0.84894757E-1
10 16.17967700 0.1856741163
11 7.941978900 0.3046790243
12 3.898410800 0.3454515448
13 1.913579300 0.2021923255
14 0.939302210 0.0382708880
15 0.461067190 0.32741956E-2
16 0.226320080 0.15021104E-3
17 0.111091790 0.47903874E-3
18 0.054530669 -0.31821261E-4
P 18
1 9780.0262000 0.36505507E-5
2 4800.6372000 0.38364739E-5
3 2356.4475000 0.25279606E-4
4 1156.6891000 0.74471021E-4
5 567.7740000 0.26448086E-3
6 278.6983300 0.87332482E-3
7 136.8022500 0.27778292E-2
8 67.15094300 0.82927386E-2
9 32.96180500 0.22358523E-1
10 16.17967700 0.50261912E-1
11 7.941978900 0.84322121E-1
12 3.898410800 0.1027551345
13 1.913579300 0.0439406597
14 0.939302210 -0.1516621272
15 0.461067190 -0.3455306449
16 0.226320080 -0.3849154447
17 0.111091790 -0.2327052014
18 0.054530669 -0.0528525390
P 1
1 1.913579300 1.0000000
P 1
1 0.939302210 1.0000000
P 1
1 0.461067190 1.0000000
P 1
1 0.226320080 1.0000000
P 1
1 0.111091790 1.0000000
P 1
1 0.054530669 1.0000000
D 1
1 8.1157469 1.0000000
D 1
1 3.6595333 1.0000000
D 1
1 1.6501480 1.0000000
D 1
1 0.7440808 1.0000000
D 1
1 0.3355191 1.0000000
D 1
1 0.1512915 1.0000000
F 1
1 1.7321483 1.0000000
F 1
1 0.7770966 1.0000000
F 1
1 0.3486301 1.0000000
F 1
1 0.1564065 1.0000000
F 1
1 0.0701689 1.0000000
G 1
1 1.5999868 1.0000000
G 1
1 0.9809852 1.0000000
G 1
1 0.6014624 1.0000000
G 1
1 0.3687691 1.0000000
H 1
1 1.5347571 1.0000000
H 1
1 0.9157262 1.0000000
H 1
1 0.5463760 1.0000000
I 1
1 1.5000000 1.0000000
I 1
1 0.7570000 1.0000000
J 1
1 1.2090000 1.0000000
$END