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QuantumPackage/tests/input/h2s.xyz

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2019-01-25 11:39:31 +01:00
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H2S Geo: Experiment Mult: 1 symmetry: 18
H 0.0 0.9569 0.9208
H 0.0 -0.9569 0.9208
S 0.0 0.0 0.0