Download - Formaldehye z matrix j5

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Page 1: Formaldehye z matrix j5

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 0.00148H 0.68393 0.18542 -0.83900O -1.18084 -0.02983 -0.13594

End