srDFT_G2/Ref/Inputs_G1/H2S.g09_not_sure_zmat
2019-03-26 20:24:09 +01:00

9 lines
70 B
Plaintext

0,1
S
X,1,1.
H,1,R,2,A
H,1,R,2,A,3,180.,0
R=1.34531822
A=46.20925632