25
cp2zrme_Cs.xyz
Zr       0.4613  -0.0054   0.0000
C        0.7481  -0.1047  -2.5046
C        0.7370   1.2755  -2.1602
C       -0.5416   1.5920  -1.6517
C       -1.3251   0.4036  -1.6679
C       -0.5290  -0.6412  -2.2173
H        1.5830  -0.6448  -2.9450
H        1.5607   1.9748  -2.2935
H       -0.8812   2.5762  -1.3471
H       -2.3758   0.3343  -1.3988
H       -0.8500  -1.6609  -2.4078
C        0.7481  -0.1047   2.5046
C       -0.5290  -0.6412   2.2173
C       -1.3251   0.4036   1.6679
C       -0.5416   1.5920   1.6517
C        0.7370   1.2755   2.1602
H        1.5830  -0.6448   2.9450
H       -0.8500  -1.6609   2.4078
H       -2.3758   0.3343   1.3988
H       -0.8812   2.5762   1.3471
H        1.5607   1.9748   2.2935
C        0.7849  -2.2440   0.0000
H        1.3759  -2.4927   0.8980
H       -0.0908  -2.9104   0.0000
H        1.3759  -2.4927  -0.8980
