srDFT_G2/G09/Mixed_core/Molecules/vdz/ClF.inp
2019-04-01 12:09:35 +02:00

10 lines
72 B
Plaintext

#p ROCCSD(T) cc-pVDZ pop=full gfprint
G2
0,1
F
Cl,1,R1
R1=1.64275079