LCPQ/quack
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quack/mol/LiF.xyz

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new molecules
2023-11-11 23:03:11 +01:00
2
additional geometries
2024-01-18 22:31:16 +01:00
Li 0.0000 0.0000 0.0000
debugging AC@BSE
2024-09-09 20:49:35 +02:00
F 0.0000 0.0000 1.5732438
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