Formaldehye z matrix j5

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Formaldehye z matrix j5

  1. 1. more methane2.input %chk=ftirone.chk %mem=3840MB %nproc=2 # hf/6-31g Opt Freq Title-niobium trimer Annette ready 0 1 H 0.48384 -0.15591 0.97346 C 0.01306 0.00032 0.00148 H 0.68393 0.18542 -0.83900 O -1.18084 -0.02983 -0.13594 End

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