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H SZV-GTH-q1 SZV-GTH
1
1 0 0 4 1
8.3744350009 -0.0283380461
1.8058681460 -0.1333810052
0.4852528328 -0.3995676063
0.1658236932 -0.5531027541
#
H DZV-GTH-q1 DZV-GTH
1
1 0 0 4 2
8.3744350009 -0.0283380461 0.0000000000
1.8058681460 -0.1333810052 0.0000000000
0.4852528328 -0.3995676063 0.0000000000
0.1658236932 -0.5531027541 1.0000000000
#
H DZVP-GTH-q1 DZVP-GTH
2
1 0 0 4 2
8.3744350009 -0.0283380461 0.0000000000
1.8058681460 -0.1333810052 0.0000000000
0.4852528328 -0.3995676063 0.0000000000
0.1658236932 -0.5531027541 1.0000000000
2 1 1 1 1
0.7270000000 1.0000000000
#
H TZVP-GTH-q1 TZVP-GTH
2
1 0 0 5 3
10.8827241585 -0.0167058885 0.0000000000 0.0000000000
3.0968750876 -0.0627538300 0.0000000000 0.0000000000
0.9874518162 -0.1917521975 0.0000000000 0.0000000000
0.3450687533 -0.4173635232 1.0000000000 0.0000000000
0.1492693554 -0.4270508887 0.0000000000 1.0000000000
2 1 1 1 1
0.7270000000 1.0000000000
#
H TZV2P-GTH-q1 TZV2P-GTH
2
1 0 0 5 3
10.8827241585 -0.0167058885 0.0000000000 0.0000000000
3.0968750876 -0.0627538300 0.0000000000 0.0000000000
0.9874518162 -0.1917521975 0.0000000000 0.0000000000
0.3450687533 -0.4173635232 1.0000000000 0.0000000000
0.1492693554 -0.4270508887 0.0000000000 1.0000000000
2 1 1 2 2
1.4070000000 1.0000000000 0.0000000000
0.3880000000 0.0000000000 1.0000000000
#
H QZV2P-GTH-q1 QZV2P-GTH
2
1 0 0 6 4
12.5350945530 0.0114321687 0.0000000000 0.0000000000 0.0000000000
4.5491539489 0.0344048283 0.0000000000 0.0000000000 0.0000000000
1.6685193606 0.1007746979 0.0000000000 0.0000000000 0.0000000000
0.6523849556 0.2302169182 1.0000000000 0.0000000000 0.0000000000
0.2733011244 0.4067637930 0.0000000000 1.0000000000 0.0000000000
0.1390608890 0.3322841300 0.0000000000 0.0000000000 1.0000000000
2 1 1 2 2
1.4070000000 1.0000000000 0.0000000000
0.3880000000 0.0000000000 1.0000000000
#
H QZV3P-GTH-q1 QZV3P-GTH
2
1 0 0 6 4
12.5350945530 0.0114321687 0.0000000000 0.0000000000 0.0000000000
4.5491539489 0.0344048283 0.0000000000 0.0000000000 0.0000000000
1.6685193606 0.1007746979 0.0000000000 0.0000000000 0.0000000000
0.6523849556 0.2302169182 1.0000000000 0.0000000000 0.0000000000
0.2733011244 0.4067637930 0.0000000000 1.0000000000 0.0000000000
0.1390608890 0.3322841300 0.0000000000 0.0000000000 1.0000000000
2 1 1 3 3
2.2920000000 1.0000000000 0.0000000000 0.0000000000
0.8380000000 0.0000000000 1.0000000000 0.0000000000
0.2920000000 0.0000000000 0.0000000000 1.0000000000
#
H aug-DZVP-GTH-q1 aug-DZVP-GTH
4
1 0 0 4 2
8.3744350009 -0.0283380461 0.0000000000
1.8058681460 -0.1333810052 0.0000000000
0.4852528328 -0.3995676063 0.0000000000
0.1658236932 -0.5531027541 1.0000000000
2 1 1 1 1
0.7270000000 1.0000000000
3 0 0 1 1
0.0297400000 1.0000000000
3 1 1 1 1
0.1410000000 1.0000000000
#
H aug-TZVP-GTH-q1 aug-TZVP-GTH
4
1 0 0 5 3
10.8827241585 -0.0167058885 0.0000000000 0.0000000000
3.0968750876 -0.0627538300 0.0000000000 0.0000000000
0.9874518162 -0.1917521975 0.0000000000 0.0000000000
0.3450687533 -0.4173635232 1.0000000000 0.0000000000
0.1492693554 -0.4270508887 0.0000000000 1.0000000000
2 1 1 1 1
0.7270000000 1.0000000000
4 0 0 1 1
0.0252600000 1.0000000000
3 1 1 1 1
0.1020000000 1.0000000000
#
H aug-TZV2P-GTH-q1 aug-TZV2P-GTH
4
1 0 0 5 3
10.8827241585 -0.0167058885 0.0000000000 0.0000000000
3.0968750876 -0.0627538300 0.0000000000 0.0000000000
0.9874518162 -0.1917521975 0.0000000000 0.0000000000
0.3450687533 -0.4173635232 1.0000000000 0.0000000000
0.1492693554 -0.4270508887 0.0000000000 1.0000000000
2 1 1 2 2
1.4070000000 1.0000000000 0.0000000000
0.3880000000 0.0000000000 1.0000000000
4 0 0 1 1
0.0252600000 1.0000000000
4 1 1 1 1
0.1020000000 1.0000000000
#
H aug-QZV2P-GTH-q1 aug-QZV2P-GTH
4
1 0 0 6 4
12.5350945530 0.0114321687 0.0000000000 0.0000000000 0.0000000000
4.5491539489 0.0344048283 0.0000000000 0.0000000000 0.0000000000
1.6685193606 0.1007746979 0.0000000000 0.0000000000 0.0000000000
0.6523849556 0.2302169182 1.0000000000 0.0000000000 0.0000000000
0.2733011244 0.4067637930 0.0000000000 1.0000000000 0.0000000000
0.1390608890 0.3322841300 0.0000000000 0.0000000000 1.0000000000
2 1 1 2 2
1.4070000000 1.0000000000 0.0000000000
0.3880000000 0.0000000000 1.0000000000
5 0 0 1 1
0.0236300000 1.0000000000
4 1 1 1 1
0.0848000000 1.0000000000
#
H aug-QZV3P-GTH-q1 aug-QZV3P-GTH
4
1 0 0 6 4
12.5350945530 0.0114321687 0.0000000000 0.0000000000 0.0000000000
4.5491539489 0.0344048283 0.0000000000 0.0000000000 0.0000000000
1.6685193606 0.1007746979 0.0000000000 0.0000000000 0.0000000000
0.6523849556 0.2302169182 1.0000000000 0.0000000000 0.0000000000
0.2733011244 0.4067637930 0.0000000000 1.0000000000 0.0000000000
0.1390608890 0.3322841300 0.0000000000 0.0000000000 1.0000000000
2 1 1 3 3
2.2920000000 1.0000000000 0.0000000000 0.0000000000
0.8380000000 0.0000000000 1.0000000000 0.0000000000
0.2920000000 0.0000000000 0.0000000000 1.0000000000
5 0 0 1 1
0.0236300000 1.0000000000
5 1 1 1 1
0.0848000000 1.0000000000
#
He SZV-GTH-q2 SZV-GTH
1
1 0 0 5 1
13.1305278312 -0.0500802904
4.1977275150 -0.1474339352
1.3647725570 -0.3245281495
0.4549715461 -0.4365284986
0.1513197845 -0.2164629317
#
He DZV-GTH-q2 DZV-GTH
1
1 0 0 5 2
13.1305278312 -0.0500802904 0.0000000000
4.1977275150 -0.1474339352 0.0000000000
1.3647725570 -0.3245281495 0.0000000000
0.4549715461 -0.4365284986 0.0000000000
0.1513197845 -0.2164629317 1.0000000000
#
He DZVP-GTH-q2 DZVP-GTH
2
1 0 0 5 2
13.1305278312 -0.0500802904 0.0000000000
4.1977275150 -0.1474339352 0.0000000000
1.3647725570 -0.3245281495 0.0000000000
0.4549715461 -0.4365284986 0.0000000000
0.1513197845 -0.2164629317 1.0000000000
2 1 1 1 1
1.2750000000 1.0000000000
#
He TZVP-GTH-q2 TZVP-GTH
2
1 0 0 6 3
14.9231368362 0.0343142688 0.0000000000 0.0000000000
5.9479610723 0.0933152472 0.0000000000 0.0000000000
2.1932485067 0.2143451850 0.0000000000 0.0000000000
0.8304881034 0.3500759421 0.0000000000 0.0000000000
0.3182586587 0.3570840512 1.0000000000 0.0000000000
0.1197839846 0.1270021790 0.0000000000 1.0000000000
2 1 1 1 1
1.2750000000 1.0000000000
#
He TZV2P-GTH-q2 TZV2P-GTH
2
1 0 0 6 3
14.9231368362 0.0343142688 0.0000000000 0.0000000000
5.9479610723 0.0933152472 0.0000000000 0.0000000000
2.1932485067 0.2143451850 0.0000000000 0.0000000000
0.8304881034 0.3500759421 0.0000000000 0.0000000000
0.3182586587 0.3570840512 1.0000000000 0.0000000000
0.1197839846 0.1270021790 0.0000000000 1.0000000000
2 1 1 2 2
3.0440000000 1.0000000000 0.0000000000
0.7580000000 0.0000000000 1.0000000000
#
He QZV2P-GTH-q2 QZV2P-GTH
2
1 0 0 7 4
16.7962354569 -0.0217345796 0.0000000000 0.0000000000 0.0000000000
8.0784265748 -0.0637981790 0.0000000000 0.0000000000 0.0000000000
3.2397448253 -0.1438730374 0.0000000000 0.0000000000 0.0000000000
1.3463173459 -0.2567923947 0.0000000000 0.0000000000 0.0000000000
0.5669193043 -0.3407783682 1.0000000000 0.0000000000 0.0000000000
0.2404041556 -0.2752209877 0.0000000000 1.0000000000 0.0000000000
0.0990547078 -0.0742573863 0.0000000000 0.0000000000 1.0000000000
2 1 1 2 2
3.0440000000 1.0000000000 0.0000000000
0.7580000000 0.0000000000 1.0000000000
#
He QZV3P-GTH-q2 QZV3P-GTH
2
1 0 0 7 4
16.7962354569 -0.0217345796 0.0000000000 0.0000000000 0.0000000000
8.0784265748 -0.0637981790 0.0000000000 0.0000000000 0.0000000000
3.2397448253 -0.1438730374 0.0000000000 0.0000000000 0.0000000000
1.3463173459 -0.2567923947 0.0000000000 0.0000000000 0.0000000000
0.5669193043 -0.3407783682 1.0000000000 0.0000000000 0.0000000000
0.2404041556 -0.2752209877 0.0000000000 1.0000000000 0.0000000000
0.0990547078 -0.0742573863 0.0000000000 0.0000000000 1.0000000000
2 1 1 3 3
5.9940000000 1.0000000000 0.0000000000 0.0000000000
1.7450000000 0.0000000000 1.0000000000 0.0000000000
0.5600000000 0.0000000000 0.0000000000 1.0000000000
#
Li SZV-GTH-q3 SZV-GTH
1
1 0 0 5 2
7.2610457926 -0.2798628497 0.0501840556
2.1056583087 -0.4477420790 0.1084202571
0.6439906571 -0.3912929157 0.1448363201
0.0797152017 -0.0282408543 -0.4643021689
0.0294029590 0.0106542324 -0.6220213304
#
Li DZVP-GTH-q3 DZVP-GTH
2
1 0 1 5 3 2
7.2610457926 -0.2798628497 0.0501840556 0.0000000000 0.0000000000 0.0000000000
2.1056583087 -0.4477420790 0.1084202571 0.0000000000 0.0000000000 0.0000000000
0.6439906571 -0.3912929157 0.1448363201 0.0000000000 1.0000000000 0.0000000000
0.0797152017 -0.0282408543 -0.4643021689 0.0000000000 0.0000000000 1.0000000000
0.0294029590 0.0106542324 -0.6220213304 1.0000000000 0.0000000000 0.0000000000
3 2 2 1 1
0.1239000000 1.0000000000
#
Li TZVP-GTH-q3 TZVP-GTH
2
1 0 1 6 4 3
9.0670525492 -0.1411283591 0.0257097367 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
4.3499909489 -0.2767569948 0.0520569091 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
1.4348215636 -0.4501634495 0.1264219750 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
0.4970537951 -0.2617675690 0.1024067911 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.0729943466 -0.0116685753 -0.5635707625 1.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0264328979 0.0038616721 -0.5290102979 0.0000000000 1.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 1 1
0.1239000000 1.0000000000
#
Li TZV2P-GTH-q3 TZV2P-GTH
2
1 0 1 6 4 3
9.0670525492 -0.1411283591 0.0257097367 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
4.3499909489 -0.2767569948 0.0520569091 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
1.4348215636 -0.4501634495 0.1264219750 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
0.4970537951 -0.2617675690 0.1024067911 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.0729943466 -0.0116685753 -0.5635707625 1.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0264328979 0.0038616721 -0.5290102979 0.0000000000 1.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
0.1874000000 1.0000000000 0.0000000000
0.0801000000 0.0000000000 1.0000000000
#
Li QZV2P-GTH-q3 QZV2P-GTH
2
1 0 1 7 5 4
11.2399728913 0.0546031957 0.0121121394 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
5.9010009273 0.2707752256 0.0442943986 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
2.1128841305 0.3250518116 0.0864603159 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
0.9242200694 0.3360526690 0.0982556510 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000
0.3843405136 0.1477938090 0.0724371635 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.0745791133 0.0049656060 -0.5608077915 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0266127545 -0.0013302258 -0.5385875662 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
0.1874000000 1.0000000000 0.0000000000
0.0801000000 0.0000000000 1.0000000000
#
Li QZV3P-GTH-q3 QZV3P-GTH
2
1 0 1 7 5 4
11.2399728913 0.0546031957 0.0121121394 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
5.9010009273 0.2707752256 0.0442943986 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
2.1128841305 0.3250518116 0.0864603159 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
0.9242200694 0.3360526690 0.0982556510 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000
0.3843405136 0.1477938090 0.0724371635 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.0745791133 0.0049656060 -0.5608077915 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0266127545 -0.0013302258 -0.5385875662 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
0.3440000000 1.0000000000 0.0000000000 0.0000000000
0.1530000000 0.0000000000 1.0000000000 0.0000000000
0.0680000000 0.0000000000 0.0000000000 1.0000000000
#
Be SZV-GTH-q4 SZV-GTH
1
1 0 0 5 2
12.0759365620 -0.2957180545 0.0588372089
3.8545761940 -0.4334460398 0.1288856096
1.2504781570 -0.3784683226 0.1550415386
0.1871714430 -0.0264606251 -0.5160084709
0.0612757198 0.0081452640 -0.5935732462
#
Be DZVP-GTH-q4 DZVP-GTH
2
1 0 1 5 3 2
12.0759365620 -0.2957180545 0.0588372089 0.0000000000 0.0000000000 0.0000000000
3.8545761940 -0.4334460398 0.1288856096 0.0000000000 0.0000000000 0.0000000000
1.2504781570 -0.3784683226 0.1550415386 0.0000000000 0.0000000000 0.0000000000
0.1871714430 -0.0264606251 -0.5160084709 0.0000000000 1.0000000000 0.0000000000
0.0612757198 0.0081452640 -0.5935732462 1.0000000000 0.0000000000 1.0000000000
3 2 2 1 1
0.2380000000 1.0000000000
#
Be TZVP-GTH-q4 TZVP-GTH
2
1 0 1 6 4 3
16.1633017560 0.1058505482 0.0252110810 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
8.2794656488 0.3142306535 0.0592234829 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
2.7431462702 0.4327355582 0.1590642952 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
1.0051192904 0.2646375740 0.0970211162 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.1765074807 0.0128485143 -0.5606394206 1.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0580432824 -0.0034494712 -0.5479256813 0.0000000000 1.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 1 1
0.2380000000 1.0000000000
#
Be TZV2P-GTH-q4 TZV2P-GTH
2
1 0 1 6 4 3
16.1633017560 0.1058505482 0.0252110810 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
8.2794656488 0.3142306535 0.0592234829 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
2.7431462702 0.4327355582 0.1590642952 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
1.0051192904 0.2646375740 0.0970211162 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.1765074807 0.0128485143 -0.5606394206 1.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0580432824 -0.0034494712 -0.5479256813 0.0000000000 1.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
0.3480000000 1.0000000000 0.0000000000
0.1803000000 0.0000000000 1.0000000000
#
Be QZV2P-GTH-q4 QZV2P-GTH
2
1 0 1 7 5 4
16.8878782250 -0.0871781047 -0.0213560020 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
8.7399964830 -0.3154557784 -0.0594803584 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
2.9043390390 -0.4227762231 -0.1487687019 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
1.0791842760 -0.2848246813 -0.1164217493 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000
0.2337917550 -0.0252413708 0.2786030195 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.1037025890 0.0110215162 0.5642008017 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0421510390 -0.0028677576 0.2754009863 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
0.3480000000 1.0000000000 0.0000000000
0.1803000000 0.0000000000 1.0000000000
#
Be QZV3P-GTH-q4 QZV3P-GTH
2
1 0 1 7 5 4
16.8878782250 -0.0871781047 -0.0213560020 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
8.7399964830 -0.3154557784 -0.0594803584 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
2.9043390390 -0.4227762231 -0.1487687019 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
1.0791842760 -0.2848246813 -0.1164217493 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000
0.2337917550 -0.0252413708 0.2786030195 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000
0.1037025890 0.0110215162 0.5642008017 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
0.0421510390 -0.0028677576 0.2754009863 0.0000000000 0.0000000000 1.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
1.0720000000 1.0000000000 0.0000000000 0.0000000000
0.4410000000 0.0000000000 1.0000000000 0.0000000000
0.1811000000 0.0000000000 0.0000000000 1.0000000000
#
B SZV-GTH-q3 SZV-GTH
1
2 0 1 4 1 1
2.8854084023 0.1420731829 -0.0759815770
0.8566849689 -0.0083257749 -0.2508281584
0.2712991753 -0.6707104603 -0.4610296144
0.0826101984 -0.4241277148 -0.4419922734
#
B DZVP-GTH-q3 DZVP-GTH
2
2 0 1 4 2 2
2.8854084023 0.1420731829 0.0000000000 -0.0759815770 0.0000000000
0.8566849689 -0.0083257749 0.0000000000 -0.2508281584 0.0000000000
0.2712991753 -0.6707104603 0.0000000000 -0.4610296144 0.0000000000
0.0826101984 -0.4241277148 1.0000000000 -0.4419922734 1.0000000000
3 2 2 1 1
0.3430000000 1.0000000000
#
B TZVP-GTH-q3 TZVP-GTH
2
2 0 1 5 3 3
3.5725567849 0.0919963366 0.0000000000 0.0000000000 -0.0431808210 0.0000000000 0.0000000000
1.3258097706 0.1075235422 0.0000000000 0.0000000000 -0.1511855730 0.0000000000 0.0000000000
0.4583887751 -0.3415470752 0.0000000000 0.0000000000 -0.3429313866 0.0000000000 0.0000000000
0.1620866416 -0.6439245174 1.0000000000 0.0000000000 -0.4414563660 1.0000000000 0.0000000000
0.0559199264 -0.1753147308 0.0000000000 1.0000000000 -0.2681154092 0.0000000000 1.0000000000
3 2 2 1 1
0.3430000000 1.0000000000
#
B TZV2P-GTH-q3 TZV2P-GTH
2
2 0 1 5 3 3
3.5725567849 0.0919963366 0.0000000000 0.0000000000 -0.0431808210 0.0000000000 0.0000000000
1.3258097706 0.1075235422 0.0000000000 0.0000000000 -0.1511855730 0.0000000000 0.0000000000
0.4583887751 -0.3415470752 0.0000000000 0.0000000000 -0.3429313866 0.0000000000 0.0000000000
0.1620866416 -0.6439245174 1.0000000000 0.0000000000 -0.4414563660 1.0000000000 0.0000000000
0.0559199264 -0.1753147308 0.0000000000 1.0000000000 -0.2681154092 0.0000000000 1.0000000000
3 2 2 2 2
0.6610000000 1.0000000000 0.0000000000
0.1990000000 0.0000000000 1.0000000000
#
B QZV2P-GTH-q3 QZV2P-GTH
2
2 0 1 6 4 4
4.1102306804 -0.0620335875 0.0000000000 0.0000000000 0.0000000000 0.0278217612 0.0000000000 0.0000000000 0.0000000000
1.7172984348 -0.1274529700 0.0000000000 0.0000000000 0.0000000000 0.1085525628 0.0000000000 0.0000000000 0.0000000000
0.6589800479 0.1200448703 0.0000000000 0.0000000000 0.0000000000 0.2367567166 0.0000000000 0.0000000000 0.0000000000
0.2700358860 0.5129734657 1.0000000000 0.0000000000 0.0000000000 0.3599759140 1.0000000000 0.0000000000 0.0000000000
0.1081818865 0.4555842541 0.0000000000 1.0000000000 0.0000000000 0.3683676413 0.0000000000 1.0000000000 0.0000000000
0.0406426579 0.0612204758 0.0000000000 0.0000000000 1.0000000000 0.1513382480 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
0.6610000000 1.0000000000 0.0000000000
0.1990000000 0.0000000000 1.0000000000
#
B QZV3P-GTH-q3 QZV3P-GTH
2
2 0 1 6 4 4
4.1102306804 -0.0620335875 0.0000000000 0.0000000000 0.0000000000 0.0278217612 0.0000000000 0.0000000000 0.0000000000
1.7172984348 -0.1274529700 0.0000000000 0.0000000000 0.0000000000 0.1085525628 0.0000000000 0.0000000000 0.0000000000
0.6589800479 0.1200448703 0.0000000000 0.0000000000 0.0000000000 0.2367567166 0.0000000000 0.0000000000 0.0000000000
0.2700358860 0.5129734657 1.0000000000 0.0000000000 0.0000000000 0.3599759140 1.0000000000 0.0000000000 0.0000000000
0.1081818865 0.4555842541 0.0000000000 1.0000000000 0.0000000000 0.3683676413 0.0000000000 1.0000000000 0.0000000000
0.0406426579 0.0612204758 0.0000000000 0.0000000000 1.0000000000 0.1513382480 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
1.1100000000 1.0000000000 0.0000000000 0.0000000000
0.4020000000 0.0000000000 1.0000000000 0.0000000000
0.1450000000 0.0000000000 0.0000000000 1.0000000000
#
C SZV-GTH-q4 SZV-GTH
1
2 0 1 4 1 1
4.3362376436 0.1490797872 -0.0878123619
1.2881838513 -0.0292640031 -0.2775560300
0.4037767149 -0.6882040510 -0.4712295093
0.1187877657 -0.3964426906 -0.4058039291
#
C DZVP-GTH-q4 DZVP-GTH
2
2 0 1 4 2 2
4.3362376436 0.1490797872 0.0000000000 -0.0878123619 0.0000000000
1.2881838513 -0.0292640031 0.0000000000 -0.2775560300 0.0000000000
0.4037767149 -0.6882040510 0.0000000000 -0.4712295093 0.0000000000
0.1187877657 -0.3964426906 1.0000000000 -0.4058039291 1.0000000000
3 2 2 1 1
0.5500000000 1.0000000000
#
C TZVP-GTH-q4 TZVP-GTH
2
2 0 1 5 3 3
5.3685662937 0.0974901974 0.0000000000 0.0000000000 -0.0510969367 0.0000000000 0.0000000000
1.9830691554 0.1041996677 0.0000000000 0.0000000000 -0.1693035193 0.0000000000 0.0000000000
0.6978346167 -0.3645093878 0.0000000000 0.0000000000 -0.3579933930 0.0000000000 0.0000000000
0.2430968816 -0.6336931464 1.0000000000 0.0000000000 -0.4327616531 1.0000000000 0.0000000000
0.0812865018 -0.1676727564 0.0000000000 1.0000000000 -0.2457672757 0.0000000000 1.0000000000
3 2 2 1 1
0.5500000000 1.0000000000
#
C TZV2P-GTH-q4 TZV2P-GTH
2
2 0 1 5 3 3
5.3685662937 0.0974901974 0.0000000000 0.0000000000 -0.0510969367 0.0000000000 0.0000000000
1.9830691554 0.1041996677 0.0000000000 0.0000000000 -0.1693035193 0.0000000000 0.0000000000
0.6978346167 -0.3645093878 0.0000000000 0.0000000000 -0.3579933930 0.0000000000 0.0000000000
0.2430968816 -0.6336931464 1.0000000000 0.0000000000 -0.4327616531 1.0000000000 0.0000000000
0.0812865018 -0.1676727564 0.0000000000 1.0000000000 -0.2457672757 0.0000000000 1.0000000000
3 2 2 2 2
1.0970000000 1.0000000000 0.0000000000
0.3180000000 0.0000000000 1.0000000000
#
C QZV2P-GTH-q4 QZV2P-GTH
2
2 0 1 6 4 4
6.2117903778 -0.0646967401 0.0000000000 0.0000000000 0.0000000000 0.0325569458 0.0000000000 0.0000000000 0.0000000000
2.6063423906 -0.1297753357 0.0000000000 0.0000000000 0.0000000000 0.1202876489 0.0000000000 0.0000000000 0.0000000000
1.0110258071 0.1365330322 0.0000000000 0.0000000000 0.0000000000 0.2556810166 0.0000000000 0.0000000000 0.0000000000
0.4099767831 0.5183875877 1.0000000000 0.0000000000 0.0000000000 0.3643736556 1.0000000000 0.0000000000 0.0000000000
0.1615409293 0.4426674841 0.0000000000 1.0000000000 0.0000000000 0.3489621232 0.0000000000 1.0000000000 0.0000000000
0.0597349919 0.0598757918 0.0000000000 0.0000000000 1.0000000000 0.1399973180 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
1.0970000000 1.0000000000 0.0000000000
0.3180000000 0.0000000000 1.0000000000
#
C QZV3P-GTH-q4 QZV3P-GTH
2
2 0 1 6 4 4
6.2117903778 -0.0646967401 0.0000000000 0.0000000000 0.0000000000 0.0325569458 0.0000000000 0.0000000000 0.0000000000
2.6063423906 -0.1297753357 0.0000000000 0.0000000000 0.0000000000 0.1202876489 0.0000000000 0.0000000000 0.0000000000
1.0110258071 0.1365330322 0.0000000000 0.0000000000 0.0000000000 0.2556810166 0.0000000000 0.0000000000 0.0000000000
0.4099767831 0.5183875877 1.0000000000 0.0000000000 0.0000000000 0.3643736556 1.0000000000 0.0000000000 0.0000000000
0.1615409293 0.4426674841 0.0000000000 1.0000000000 0.0000000000 0.3489621232 0.0000000000 1.0000000000 0.0000000000
0.0597349919 0.0598757918 0.0000000000 0.0000000000 1.0000000000 0.1399973180 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
1.8480000000 1.0000000000 0.0000000000 0.0000000000
0.6490000000 0.0000000000 1.0000000000 0.0000000000
0.2280000000 0.0000000000 0.0000000000 1.0000000000
#
C aug-DZVP-GTH-q4 aug-DZVP-GTH
4
2 0 1 4 2 2
4.3362376436 0.1490797872 0.0000000000 -0.0878123619 0.0000000000
1.2881838513 -0.0292640031 0.0000000000 -0.2775560300 0.0000000000
0.4037767149 -0.6882040510 0.0000000000 -0.4712295093 0.0000000000
0.1187877657 -0.3964426906 1.0000000000 -0.4058039291 1.0000000000
3 2 2 1 1
0.5500000000 1.0000000000
2 0 0 1 1
0.04690000 1.0000000000
2 1 1 1 1
0.04041000 1.0000000000
#
C aug-TZVP-GTH-q4 aug-TZVP-GTH
4
2 0 1 5 3 3
5.3685662937 0.0974901974 0.0000000000 0.0000000000 -0.0510969367 0.0000000000 0.0000000000
1.9830691554 0.1041996677 0.0000000000 0.0000000000 -0.1693035193 0.0000000000 0.0000000000
0.6978346167 -0.3645093878 0.0000000000 0.0000000000 -0.3579933930 0.0000000000 0.0000000000
0.2430968816 -0.6336931464 1.0000000000 0.0000000000 -0.4327616531 1.0000000000 0.0000000000
0.0812865018 -0.1676727564 0.0000000000 1.0000000000 -0.2457672757 0.0000000000 1.0000000000
3 2 2 1 1
0.5500000000 1.0000000000
2 0 0 1 1
0.04402000 1.0000000000
2 1 1 1 1
0.03569000 1.0000000000
#
C aug-TZV2P-GTH-q4 aug-TZV2P-GTH
4
2 0 1 5 3 3
5.3685662937 0.0974901974 0.0000000000 0.0000000000 -0.0510969367 0.0000000000 0.0000000000
1.9830691554 0.1041996677 0.0000000000 0.0000000000 -0.1693035193 0.0000000000 0.0000000000
0.6978346167 -0.3645093878 0.0000000000 0.0000000000 -0.3579933930 0.0000000000 0.0000000000
0.2430968816 -0.6336931464 1.0000000000 0.0000000000 -0.4327616531 1.0000000000 0.0000000000
0.0812865018 -0.1676727564 0.0000000000 1.0000000000 -0.2457672757 0.0000000000 1.0000000000
3 2 2 2 2
1.0970000000 1.0000000000 0.0000000000
0.3180000000 0.0000000000 1.0000000000
2 0 0 1 1
0.04402000 1.0000000000
2 1 1 1 1
0.03569000 1.0000000000
#
C aug-QZV2P-GTH-q4 aug-QZV2P-GTH
4
2 0 1 6 4 4
6.2117903778 -0.0646967401 0.0000000000 0.0000000000 0.0000000000 0.0325569458 0.0000000000 0.0000000000 0.0000000000
2.6063423906 -0.1297753357 0.0000000000 0.0000000000 0.0000000000 0.1202876489 0.0000000000 0.0000000000 0.0000000000
1.0110258071 0.1365330322 0.0000000000 0.0000000000 0.0000000000 0.2556810166 0.0000000000 0.0000000000 0.0000000000
0.4099767831 0.5183875877 1.0000000000 0.0000000000 0.0000000000 0.3643736556 1.0000000000 0.0000000000 0.0000000000
0.1615409293 0.4426674841 0.0000000000 1.0000000000 0.0000000000 0.3489621232 0.0000000000 1.0000000000 0.0000000000
0.0597349919 0.0598757918 0.0000000000 0.0000000000 1.0000000000 0.1399973180 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
1.0970000000 1.0000000000 0.0000000000
0.3180000000 0.0000000000 1.0000000000
2 0 0 1 1
0.04145000 1.0000000000
2 1 1 1 1
0.03218000 1.0000000000
#
C aug-QZV3P-GTH-q4 aug-QZV3P-GTH
4
2 0 1 6 4 4
6.2117903778 -0.0646967401 0.0000000000 0.0000000000 0.0000000000 0.0325569458 0.0000000000 0.0000000000 0.0000000000
2.6063423906 -0.1297753357 0.0000000000 0.0000000000 0.0000000000 0.1202876489 0.0000000000 0.0000000000 0.0000000000
1.0110258071 0.1365330322 0.0000000000 0.0000000000 0.0000000000 0.2556810166 0.0000000000 0.0000000000 0.0000000000
0.4099767831 0.5183875877 1.0000000000 0.0000000000 0.0000000000 0.3643736556 1.0000000000 0.0000000000 0.0000000000
0.1615409293 0.4426674841 0.0000000000 1.0000000000 0.0000000000 0.3489621232 0.0000000000 1.0000000000 0.0000000000
0.0597349919 0.0598757918 0.0000000000 0.0000000000 1.0000000000 0.1399973180 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
1.8480000000 1.0000000000 0.0000000000 0.0000000000
0.6490000000 0.0000000000 1.0000000000 0.0000000000
0.2280000000 0.0000000000 0.0000000000 1.0000000000
2 0 0 1 1
0.04145000 1.0000000000
2 1 1 1 1
0.03218000 1.0000000000
#
N SZV-GTH-q5 SZV-GTH
1
2 0 1 4 1 1
6.1526903413 0.1506300537 -0.0950603476
1.8236332280 -0.0360100734 -0.2918864295
0.5676628870 -0.6942023212 -0.4739050050
0.1628222852 -0.3878929987 -0.3893418670
#
N DZVP-GTH-q5 DZVP-GTH
2
2 0 1 4 2 2
6.1526903413 0.1506300537 0.0000000000 -0.0950603476 0.0000000000
1.8236332280 -0.0360100734 0.0000000000 -0.2918864295 0.0000000000
0.5676628870 -0.6942023212 0.0000000000 -0.4739050050 0.0000000000
0.1628222852 -0.3878929987 1.0000000000 -0.3893418670 1.0000000000
3 2 2 1 1
0.8170000000 1.0000000000
#
N TZVP-GTH-q5 TZVP-GTH
2
2 0 1 5 3 3
7.6227447102 0.0983924689 0.0000000000 0.0000000000 -0.0561654555 0.0000000000 0.0000000000
2.7970605447 0.1045217098 0.0000000000 0.0000000000 -0.1798165209 0.0000000000 0.0000000000
0.9909765447 -0.3742661352 0.0000000000 0.0000000000 -0.3653986185 0.0000000000 0.0000000000
0.3417314862 -0.6278094034 1.0000000000 0.0000000000 -0.4259126207 1.0000000000 0.0000000000
0.1116822743 -0.1675236192 0.0000000000 1.0000000000 -0.2366040346 0.0000000000 1.0000000000
3 2 2 1 1
0.8170000000 1.0000000000
#
N TZV2P-GTH-q5 TZV2P-GTH
2
2 0 1 5 3 3
7.6227447102 0.0983924689 0.0000000000 0.0000000000 -0.0561654555 0.0000000000 0.0000000000
2.7970605447 0.1045217098 0.0000000000 0.0000000000 -0.1798165209 0.0000000000 0.0000000000
0.9909765447 -0.3742661352 0.0000000000 0.0000000000 -0.3653986185 0.0000000000 0.0000000000
0.3417314862 -0.6278094034 1.0000000000 0.0000000000 -0.4259126207 1.0000000000 0.0000000000
0.1116822743 -0.1675236192 0.0000000000 1.0000000000 -0.2366040346 0.0000000000 1.0000000000
3 2 2 2 2
1.6540000000 1.0000000000 0.0000000000
0.4690000000 0.0000000000 1.0000000000
#
N QZV2P-GTH-q5 QZV2P-GTH
2
2 0 1 6 4 4
8.8030997240 -0.0653598725 0.0000000000 0.0000000000 0.0000000000 0.0363703004 0.0000000000 0.0000000000 0.0000000000
3.6785202400 -0.1318019698 0.0000000000 0.0000000000 0.0000000000 0.1277243136 0.0000000000 0.0000000000 0.0000000000
1.4352947631 0.1465239013 0.0000000000 0.0000000000 0.0000000000 0.2667499496 0.0000000000 0.0000000000 0.0000000000
0.5774326402 0.5201300002 1.0000000000 0.0000000000 0.0000000000 0.3658846849 1.0000000000 0.0000000000 0.0000000000
0.2247320708 0.4360365020 0.0000000000 1.0000000000 0.0000000000 0.3370061673 0.0000000000 1.0000000000 0.0000000000
0.0818920852 0.0597929754 0.0000000000 0.0000000000 1.0000000000 0.1349212947 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
1.6540000000 1.0000000000 0.0000000000
0.4690000000 0.0000000000 1.0000000000
#
N QZV3P-GTH-q5 QZV3P-GTH
2
2 0 1 6 4 4
8.8030997240 -0.0653598725 0.0000000000 0.0000000000 0.0000000000 0.0363703004 0.0000000000 0.0000000000 0.0000000000
3.6785202400 -0.1318019698 0.0000000000 0.0000000000 0.0000000000 0.1277243136 0.0000000000 0.0000000000 0.0000000000
1.4352947631 0.1465239013 0.0000000000 0.0000000000 0.0000000000 0.2667499496 0.0000000000 0.0000000000 0.0000000000
0.5774326402 0.5201300002 1.0000000000 0.0000000000 0.0000000000 0.3658846849 1.0000000000 0.0000000000 0.0000000000
0.2247320708 0.4360365020 0.0000000000 1.0000000000 0.0000000000 0.3370061673 0.0000000000 1.0000000000 0.0000000000
0.0818920852 0.0597929754 0.0000000000 0.0000000000 1.0000000000 0.1349212947 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
2.8370000000 1.0000000000 0.0000000000 0.0000000000
0.9680000000 0.0000000000 1.0000000000 0.0000000000
0.3350000000 0.0000000000 0.0000000000 1.0000000000
#
N aug-DZVP-GTH-q5 aug-DZVP-GTH
4
2 0 1 4 2 2
6.1526903413 0.1506300537 0.0000000000 -0.0950603476 0.0000000000
1.8236332280 -0.0360100734 0.0000000000 -0.2918864295 0.0000000000
0.5676628870 -0.6942023212 0.0000000000 -0.4739050050 0.0000000000
0.1628222852 -0.3878929987 1.0000000000 -0.3893418670 1.0000000000
3 2 2 1 1
0.8170000000 1.0000000000
2 0 0 1 1
0.06124000 1.0000000000
2 1 1 1 1
0.05611000 1.0000000000
#
N aug-TZVP-GTH-q5 aug-TZVP-GTH
4
2 0 1 5 3 3
7.6227447102 0.0983924689 0.0000000000 0.0000000000 -0.0561654555 0.0000000000 0.0000000000
2.7970605447 0.1045217098 0.0000000000 0.0000000000 -0.1798165209 0.0000000000 0.0000000000
0.9909765447 -0.3742661352 0.0000000000 0.0000000000 -0.3653986185 0.0000000000 0.0000000000
0.3417314862 -0.6278094034 1.0000000000 0.0000000000 -0.4259126207 1.0000000000 0.0000000000
0.1116822743 -0.1675236192 0.0000000000 1.0000000000 -0.2366040346 0.0000000000 1.0000000000
3 2 2 1 1
0.8170000000 1.0000000000
2 0 0 1 1
0.05760000 1.0000000000
2 1 1 1 1
0.04910000 1.0000000000
#
N aug-TZV2P-GTH-q5 aug-TZV2P-GTH
4
2 0 1 5 3 3
7.6227447102 0.0983924689 0.0000000000 0.0000000000 -0.0561654555 0.0000000000 0.0000000000
2.7970605447 0.1045217098 0.0000000000 0.0000000000 -0.1798165209 0.0000000000 0.0000000000
0.9909765447 -0.3742661352 0.0000000000 0.0000000000 -0.3653986185 0.0000000000 0.0000000000
0.3417314862 -0.6278094034 1.0000000000 0.0000000000 -0.4259126207 1.0000000000 0.0000000000
0.1116822743 -0.1675236192 0.0000000000 1.0000000000 -0.2366040346 0.0000000000 1.0000000000
3 2 2 2 2
1.6540000000 1.0000000000 0.0000000000
0.4690000000 0.0000000000 1.0000000000
2 0 0 1 1
0.05760000 1.0000000000
2 1 1 1 1
0.04910000 1.0000000000
#
N aug-QZV2P-GTH-q5 aug-QZV2P-GTH
4
2 0 1 6 4 4
8.8030997240 -0.0653598725 0.0000000000 0.0000000000 0.0000000000 0.0363703004 0.0000000000 0.0000000000 0.0000000000
3.6785202400 -0.1318019698 0.0000000000 0.0000000000 0.0000000000 0.1277243136 0.0000000000 0.0000000000 0.0000000000
1.4352947631 0.1465239013 0.0000000000 0.0000000000 0.0000000000 0.2667499496 0.0000000000 0.0000000000 0.0000000000
0.5774326402 0.5201300002 1.0000000000 0.0000000000 0.0000000000 0.3658846849 1.0000000000 0.0000000000 0.0000000000
0.2247320708 0.4360365020 0.0000000000 1.0000000000 0.0000000000 0.3370061673 0.0000000000 1.0000000000 0.0000000000
0.0818920852 0.0597929754 0.0000000000 0.0000000000 1.0000000000 0.1349212947 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
1.6540000000 1.0000000000 0.0000000000
0.4690000000 0.0000000000 1.0000000000
2 0 0 1 1
0.05464000 1.0000000000
2 1 1 1 1
0.04402000 1.0000000000
#
N aug-QZV3P-GTH-q5 aug-QZV3P-GTH
4
2 0 1 6 4 4
8.8030997240 -0.0653598725 0.0000000000 0.0000000000 0.0000000000 0.0363703004 0.0000000000 0.0000000000 0.0000000000
3.6785202400 -0.1318019698 0.0000000000 0.0000000000 0.0000000000 0.1277243136 0.0000000000 0.0000000000 0.0000000000
1.4352947631 0.1465239013 0.0000000000 0.0000000000 0.0000000000 0.2667499496 0.0000000000 0.0000000000 0.0000000000
0.5774326402 0.5201300002 1.0000000000 0.0000000000 0.0000000000 0.3658846849 1.0000000000 0.0000000000 0.0000000000
0.2247320708 0.4360365020 0.0000000000 1.0000000000 0.0000000000 0.3370061673 0.0000000000 1.0000000000 0.0000000000
0.0818920852 0.0597929754 0.0000000000 0.0000000000 1.0000000000 0.1349212947 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
2.8370000000 1.0000000000 0.0000000000 0.0000000000
0.9680000000 0.0000000000 1.0000000000 0.0000000000
0.3350000000 0.0000000000 0.0000000000 1.0000000000
2 0 0 1 1
0.05464000 1.0000000000
2 1 1 1 1
0.04402000 1.0000000000
#
O SZV-GTH-q6 SZV-GTH
1
2 0 1 4 1 1
8.3043855492 0.1510165999 -0.0995679273
2.4579484191 -0.0393195364 -0.3011422449
0.7597373434 -0.6971724029 -0.4750857083
0.2136388632 -0.3841133622 -0.3798777957
#
O DZVP-GTH-q6 DZVP-GTH
2
2 0 1 4 2 2
8.3043855492 0.1510165999 0.0000000000 -0.0995679273 0.0000000000
2.4579484191 -0.0393195364 0.0000000000 -0.3011422449 0.0000000000
0.7597373434 -0.6971724029 0.0000000000 -0.4750857083 0.0000000000
0.2136388632 -0.3841133622 1.0000000000 -0.3798777957 1.0000000000
3 2 2 1 1
1.1850000000 1.0000000000
#
O TZVP-GTH-q6 TZVP-GTH
2
2 0 1 5 3 3
10.2674419938 0.0989598460 0.0000000000 0.0000000000 -0.0595856940 0.0000000000 0.0000000000
3.7480495696 0.1041178339 0.0000000000 0.0000000000 -0.1875649045 0.0000000000 0.0000000000
1.3308337704 -0.3808255700 0.0000000000 0.0000000000 -0.3700707718 0.0000000000 0.0000000000
0.4556802254 -0.6232449802 1.0000000000 0.0000000000 -0.4204922615 1.0000000000 0.0000000000
0.1462920596 -0.1677863491 0.0000000000 1.0000000000 -0.2313901687 0.0000000000 1.0000000000
3 2 2 1 1
1.1850000000 1.0000000000
#
O TZV2P-GTH-q6 TZV2P-GTH
2
2 0 1 5 3 3
10.2674419938 0.0989598460 0.0000000000 0.0000000000 -0.0595856940 0.0000000000 0.0000000000
3.7480495696 0.1041178339 0.0000000000 0.0000000000 -0.1875649045 0.0000000000 0.0000000000
1.3308337704 -0.3808255700 0.0000000000 0.0000000000 -0.3700707718 0.0000000000 0.0000000000
0.4556802254 -0.6232449802 1.0000000000 0.0000000000 -0.4204922615 1.0000000000 0.0000000000
0.1462920596 -0.1677863491 0.0000000000 1.0000000000 -0.2313901687 0.0000000000 1.0000000000
3 2 2 2 2
2.3140000000 1.0000000000 0.0000000000
0.6450000000 0.0000000000 1.0000000000
#
O QZV2P-GTH-q6 QZV2P-GTH
2
2 0 1 6 4 4
11.8298677444 -0.0658681959 0.0000000000 0.0000000000 0.0000000000 0.0389990698 0.0000000000 0.0000000000 0.0000000000
4.9326307395 -0.1327117781 0.0000000000 0.0000000000 0.0000000000 0.1329824319 0.0000000000 0.0000000000 0.0000000000
1.9312997298 0.1529660213 0.0000000000 0.0000000000 0.0000000000 0.2737974007 0.0000000000 0.0000000000 0.0000000000
0.7724003899 0.5206439978 1.0000000000 0.0000000000 0.0000000000 0.3663338041 1.0000000000 0.0000000000 0.0000000000
0.2976334392 0.4322622254 0.0000000000 1.0000000000 0.0000000000 0.3292638764 0.0000000000 1.0000000000 0.0000000000
0.1070061063 0.0599977177 0.0000000000 0.0000000000 1.0000000000 0.1324571183 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
2.3140000000 1.0000000000 0.0000000000
0.6450000000 0.0000000000 1.0000000000
#
O QZV3P-GTH-q6 QZV3P-GTH
2
2 0 1 6 4 4
11.8298677444 -0.0658681959 0.0000000000 0.0000000000 0.0000000000 0.0389990698 0.0000000000 0.0000000000 0.0000000000
4.9326307395 -0.1327117781 0.0000000000 0.0000000000 0.0000000000 0.1329824319 0.0000000000 0.0000000000 0.0000000000
1.9312997298 0.1529660213 0.0000000000 0.0000000000 0.0000000000 0.2737974007 0.0000000000 0.0000000000 0.0000000000
0.7724003899 0.5206439978 1.0000000000 0.0000000000 0.0000000000 0.3663338041 1.0000000000 0.0000000000 0.0000000000
0.2976334392 0.4322622254 0.0000000000 1.0000000000 0.0000000000 0.3292638764 0.0000000000 1.0000000000 0.0000000000
0.1070061063 0.0599977177 0.0000000000 0.0000000000 1.0000000000 0.1324571183 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
3.7750000000 1.0000000000 0.0000000000 0.0000000000
1.3000000000 0.0000000000 1.0000000000 0.0000000000
0.4440000000 0.0000000000 0.0000000000 1.0000000000
#
O aug-DZVP-GTH-q6 aug-DZVP-GTH
4
2 0 1 4 2 2
8.3043855492 0.1510165999 0.0000000000 -0.0995679273 0.0000000000
2.4579484191 -0.0393195364 0.0000000000 -0.3011422449 0.0000000000
0.7597373434 -0.6971724029 0.0000000000 -0.4750857083 0.0000000000
0.2136388632 -0.3841133622 1.0000000000 -0.3798777957 1.0000000000
3 2 2 1 1
1.1850000000 1.0000000000
4 0 0 1 1
0.0789600000 1.0000000000
4 1 1 1 1
0.0685600000 1.0000000000
#
O aug-TZVP-GTH-q6 aug-TZVP-GTH
4
2 0 1 5 3 3
10.2674419938 0.0989598460 0.0000000000 0.0000000000 -0.0595856940 0.0000000000 0.0000000000 0.0000000000
3.7480495696 0.1041178339 0.0000000000 0.0000000000 -0.1875649045 0.0000000000 0.0000000000 0.0000000000
1.3308337704 -0.3808255700 0.0000000000 0.0000000000 -0.3700707718 0.0000000000 0.0000000000 0.0000000000
0.4556802254 -0.6232449802 1.0000000000 0.0000000000 -0.4204922615 1.0000000000 0.0000000000 0.0000000000
0.1462920596 -0.1677863491 0.0000000000 1.0000000000 -0.2313901687 0.0000000000 1.0000000000 0.0000000000
3 2 2 1 1
1.1850000000 1.0000000000
5 0 0 1 1
0.0737600000 1.0000000000
5 1 1 1 1
0.0597400000 1.0000000000
#
O aug-TZV2P-GTH-q6 aug-TZV2P-GTH
4
2 0 1 5 3 3
10.2674419938 0.0989598460 0.0000000000 0.0000000000 -0.0595856940 0.0000000000 0.0000000000 0.0000000000
3.7480495696 0.1041178339 0.0000000000 0.0000000000 -0.1875649045 0.0000000000 0.0000000000 0.0000000000
1.3308337704 -0.3808255700 0.0000000000 0.0000000000 -0.3700707718 0.0000000000 0.0000000000 0.0000000000
0.4556802254 -0.6232449802 1.0000000000 0.0000000000 -0.4204922615 1.0000000000 0.0000000000 0.0000000000
0.1462920596 -0.1677863491 0.0000000000 1.0000000000 -0.2313901687 0.0000000000 1.0000000000 0.0000000000
3 2 2 2 2
2.3140000000 1.0000000000 0.0000000000
0.6450000000 0.0000000000 1.0000000000
5 0 0 1 1
0.0737600000 1.0000000000
5 1 1 1 1
0.0597400000 1.0000000000
#
O aug-QZV2P-GTH-q6 aug-QZV2P-GTH
4
2 0 1 6 4 4
11.8298677444 -0.0658681959 0.0000000000 0.0000000000 0.0000000000 0.0389990698 0.0000000000 0.0000000000 0.0000000000
4.9326307395 -0.1327117781 0.0000000000 0.0000000000 0.0000000000 0.1329824319 0.0000000000 0.0000000000 0.0000000000
1.9312997298 0.1529660213 0.0000000000 0.0000000000 0.0000000000 0.2737974007 0.0000000000 0.0000000000 0.0000000000
0.7724003899 0.5206439978 1.0000000000 0.0000000000 0.0000000000 0.3663338041 1.0000000000 0.0000000000 0.0000000000
0.2976334392 0.4322622254 0.0000000000 1.0000000000 0.0000000000 0.3292638764 0.0000000000 1.0000000000 0.0000000000
0.1070061063 0.0599977177 0.0000000000 0.0000000000 1.0000000000 0.1324571183 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
2.3140000000 1.0000000000 0.0000000000
0.6450000000 0.0000000000 1.0000000000
6 0 0 1 1
0.0695900000 1.0000000000
6 1 1 1 1
0.0534800000 1.0000000000
#
O aug-QZV3P-GTH-q6 aug-QZV3P-GTH
4
2 0 1 6 4 4
11.8298677444 -0.0658681959 0.0000000000 0.0000000000 0.0000000000 0.0389990698 0.0000000000 0.0000000000 0.0000000000
4.9326307395 -0.1327117781 0.0000000000 0.0000000000 0.0000000000 0.1329824319 0.0000000000 0.0000000000 0.0000000000
1.9312997298 0.1529660213 0.0000000000 0.0000000000 0.0000000000 0.2737974007 0.0000000000 0.0000000000 0.0000000000
0.7724003899 0.5206439978 1.0000000000 0.0000000000 0.0000000000 0.3663338041 1.0000000000 0.0000000000 0.0000000000
0.2976334392 0.4322622254 0.0000000000 1.0000000000 0.0000000000 0.3292638764 0.0000000000 1.0000000000 0.0000000000
0.1070061063 0.0599977177 0.0000000000 0.0000000000 1.0000000000 0.1324571183 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
3.7750000000 1.0000000000 0.0000000000 0.0000000000
1.3000000000 0.0000000000 1.0000000000 0.0000000000
0.4440000000 0.0000000000 0.0000000000 1.0000000000
6 0 0 1 1
0.0695900000 1.0000000000
6 1 1 1 1
0.0534800000 1.0000000000
#
F SZV-GTH-q7 SZV-GTH
1
2 0 1 4 1 1
10.7079832847 0.1525178777 -0.1028649478
3.1757210204 -0.0450363043 -0.3085265610
0.9750975650 -0.6987425604 -0.4757649909
0.2701246771 -0.3801470341 -0.3724954705
#
F DZVP-GTH-q7 DZVP-GTH
2
2 0 1 4 2 2
10.7079832847 0.1525178777 0.0000000000 -0.1028649478 0.0000000000
3.1757210204 -0.0450363043 0.0000000000 -0.3085265610 0.0000000000
0.9750975650 -0.6987425604 0.0000000000 -0.4757649909 0.0000000000
0.2701246771 -0.3801470341 1.0000000000 -0.3724954705 1.0000000000
3 2 2 1 1
1.6400000000 1.0000000000
#
F TZVP-GTH-q7 TZVP-GTH
2
2 0 1 5 3 3
13.1625129789 0.1014784435 0.0000000000 0.0000000000 -0.0624161251 0.0000000000 0.0000000000
4.7972015127 0.1001604122 0.0000000000 0.0000000000 -0.1948710850 0.0000000000 0.0000000000
1.7049975196 -0.3881644200 0.0000000000 0.0000000000 -0.3737338926 0.0000000000 0.0000000000
0.5814471097 -0.6179394476 1.0000000000 0.0000000000 -0.4151939502 1.0000000000 0.0000000000
0.1842582220 -0.1660215122 0.0000000000 1.0000000000 -0.2267411587 0.0000000000 1.0000000000
3 2 2 1 1
1.6400000000 1.0000000000
#
F TZV2P-GTH-q7 TZV2P-GTH
2
2 0 1 5 3 3
13.1625129789 0.1014784435 0.0000000000 0.0000000000 -0.0624161251 0.0000000000 0.0000000000
4.7972015127 0.1001604122 0.0000000000 0.0000000000 -0.1948710850 0.0000000000 0.0000000000
1.7049975196 -0.3881644200 0.0000000000 0.0000000000 -0.3737338926 0.0000000000 0.0000000000
0.5814471097 -0.6179394476 1.0000000000 0.0000000000 -0.4151939502 1.0000000000 0.0000000000
0.1842582220 -0.1660215122 0.0000000000 1.0000000000 -0.2267411587 0.0000000000 1.0000000000
3 2 2 2 2
3.1070000000 1.0000000000 0.0000000000
0.8550000000 0.0000000000 1.0000000000
#
F QZV2P-GTH-q7 QZV2P-GTH
2
2 0 1 6 4 4
15.1623003547 -0.0676084899 0.0000000000 0.0000000000 0.0000000000 0.0407647530 0.0000000000 0.0000000000 0.0000000000
6.3418425141 -0.1317375108 0.0000000000 0.0000000000 0.0000000000 0.1374408584 0.0000000000 0.0000000000 0.0000000000
2.4900230297 0.1587177173 0.0000000000 0.0000000000 0.0000000000 0.2789708771 0.0000000000 0.0000000000 0.0000000000
0.9919240308 0.5210056191 1.0000000000 0.0000000000 0.0000000000 0.3662011969 1.0000000000 0.0000000000 0.0000000000
0.3793151196 0.4286790556 0.0000000000 1.0000000000 0.0000000000 0.3234540792 0.0000000000 1.0000000000 0.0000000000
0.1348132586 0.0598520782 0.0000000000 0.0000000000 1.0000000000 0.1307942509 0.0000000000 0.0000000000 1.0000000000
3 2 2 2 2
3.1070000000 1.0000000000 0.0000000000
0.8550000000 0.0000000000 1.0000000000
#
F QZV3P-GTH-q7 QZV3P-GTH
2
2 0 1 6 4 4
15.1623003547 -0.0676084899 0.0000000000 0.0000000000 0.0000000000 0.0407647530 0.0000000000 0.0000000000 0.0000000000
6.3418425141 -0.1317375108 0.0000000000 0.0000000000 0.0000000000 0.1374408584 0.0000000000 0.0000000000 0.0000000000
2.4900230297 0.1587177173 0.0000000000 0.0000000000 0.0000000000 0.2789708771 0.0000000000 0.0000000000 0.0000000000
0.9919240308 0.5210056191 1.0000000000 0.0000000000 0.0000000000 0.3662011969 1.0000000000 0.0000000000 0.0000000000
0.3793151196 0.4286790556 0.0000000000 1.0000000000 0.0000000000 0.3234540792 0.0000000000 1.0000000000 0.0000000000
0.1348132586 0.0598520782 0.0000000000 0.0000000000 1.0000000000 0.1307942509 0.0000000000 0.0000000000 1.0000000000
3 2 2 3 3
5.0140000000 1.0000000000 0.0000000000 0.0000000000
1.7250000000 0.0000000000 1.0000000000 0.0000000000
0.5860000000 0.0000000000 0.0000000000 1.0000000000
#
F aug-DZVP-GTH-q7 aug-DZVP-GTH
4
2 0 1 4 2 2
10.7079832847 0.1525178777 0.0000000000 -0.1028649478 0.0000000000
3.1757210204 -0.0450363043 0.0000000000 -0.3085265610 0.0000000000
0.9750975650 -0.6987425604 0.0000000000 -0.4757649909 0.0000000000
0.2701246771 -0.3801470341 1.0000000000 -0.3724954705 1.0000000000
3 2 2 1 1
1.6400000000 1.0000000000
2 0 0 1 1
0.09863000 1.0000000000
2 1 1 1 1
0.08502000 1.0000000000
#
F aug-TZVP-GTH-q7 aug-TZVP-GTH
4
2 0 1 5 3 3
13.1625129789 0.1014784435 0.0000000000 0.0000000000 -0.0624161251 0.0000000000 0.0000000000
4.7972015127 0.1001604122 0.0000000000 0.0000000000 -0.1948710850 0.0000000000 0.0000000000
1.7049975196 -0.3881644200 0.0000000000 0.0000000000 -0.3737338926 0.0000000000 0.0000000000
0.5814471097 -0.6179394476 1.0000000000 0.0000000000 -0.4151939502 1.0000000000 0.0000000000
0.1842582220 -0.1660215122 0.0000000000 1.0000000000 -0.2267411587 0.0000000000 1.0000000000
3 2 2 1 1
1.6400000000 1.0000000000
2 0 0 1 1
0.09158000 1.0000000000
2 1 1 1 1
0.07361000 1.0000000000
#
F aug-TZV2P-GTH-q7 aug-TZV2P-GTH
4
2 0 1 5 3 3
13.1625129789 0.1014784435 0.0000000000 0.0000000000 -0.0624161251 0.0000000000 0.0000000000