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QCaml/test/water.xyz

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2018-07-04 20:24:51 +02:00
3
Water
O 0. 0. 0.
H -0.756950272703377558 0. -0.585882234512562827
H 0.756950272703377558 0. -0.585882234512562827
2020-09-26 12:02:53 +02:00