srDFT_G2/Ref/Molecules/g09/VTZ/Si2H6.inp

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2019-03-26 11:00:25 +01:00
#p ROCCSD(T) cc-pVTZ pop=full gfprint
G2
0,1
Si
Si,1,R
H,1,SIH,2,SICC
H,1,SIH,2,SICC,3,120.,0
H,1,SIH,2,SICC,3,-120.,0
H,2,SIH,1,SICC,3,180.,0
H,2,SIH,1,SICC,6,120.,0
H,2,SIH,1,SICC,6,-120.,0
SICC=110.49912192
SIH=1.48548901
R=2.35421744