srDFT_G2/Ref/Inputs_G1/HCN.g09_not_sure_zmat
2019-03-26 20:24:09 +01:00

9 lines
77 B
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0,1
C
N,1,AB
X,1,1.,2,90.
H,1,AH,3,90.,2,180.,0
AB=1.15174191
AH=1.06658792