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srDFT_G2
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61a118bc11
srDFT_G2
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G09
/
Large_core
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Molecules
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vdz
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OH.xyz
eginer
429b6f404d
re-added Large_core
2019-03-28 15:06:14 +01:00
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O
H,1,ROH
ROH=0.97613331
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