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

9 lines
76 B
Plaintext

0,1
O
H,1,OH
Cl,1,OCl,2,HOCl
OH=0.96804646
OCl=1.7074574
HOCl=102.46612245