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QuAcK/examples/basis.H2.6-31Gss

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2019-03-19 10:18:03 +01:00
1 3
S 3 1.00
18.7311370 0.03349460
2.8253937 0.23472695
0.6401217 0.81375733
S 1 1.00
0.1612778 1.0000000
P 1 1.00
1.1000000 1.0000000
2 3
S 3 1.00
18.7311370 0.03349460
2.8253937 0.23472695
0.6401217 0.81375733
S 1 1.00
0.1612778 1.0000000
P 1 1.00
1.1000000 1.0000000