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LCPQ
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quack
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quack
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mol
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h2.xyz
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xyz files
2020-10-12 14:30:00 +02:00
2
H 0.0 0.0 0.0
mix guess for UHF
2020-10-27 17:23:48 +01:00
H 0.0 0.0 3.0
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