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QuAcK/examples/basis.CH+.6-31Gs

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2019-03-19 10:18:03 +01:00
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P 1 1.00
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D 1 1.00
0.8000000 1.0000000
2 2
S 3 1.00
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2.8253937 0.23472695
0.6401217 0.81375733
S 1 1.00
0.1612778 1.0000000