srDFT_G2/G09/Large_core/Molecules/vqz/CN.inp
2019-04-01 09:40:22 +02:00

10 lines
69 B
Plaintext

#p ROCCSD(T) cc-pVQZ pop=full gfprint
G2
0,2
C
N,1,R
R=1.16945125