srDFT_G2/Ref/Molecules/g09/VDZ/HCO.inp
2019-03-26 11:00:25 +01:00

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#p ROCCSD(T) cc-pVDZ pop=full gfprint
G2
0,2
C
O,1,CO
H,1,CH,2,HCO
CO=1.17621067
CH=1.12859543
HCO=124.03532275