quack/mol/sicl2.xyz

5 lines
217 B
Plaintext

3
\ce{SiCl2},^1A_1,CC3,aug-cc-pVTZ
Si 0.00000000 0.00000000 -0.94473119
Cl 0.00000000 1.61089231 0.37899364
Cl 0.00000000 -1.61089231 0.37899364