31
cp2zrme_c2h4_pi_Cs.xyz                            
Zr         0.065373 -0.076788  0.000000
C          2.339106 -0.013582  0.000000
C         -0.983210  2.726810  0.000000
H          2.884524 -0.968824  0.000000
H          2.665616  0.536942 -0.898916
H          2.665616  0.536942  0.898916
C          0.209440  0.077515  2.541280
C          0.675872 -1.205136  2.168991
C         -0.416389 -1.916055  1.602956
C         -1.561610 -1.075627  1.647933
C         -1.174865  0.150270  2.229320
H          0.797468  0.852336  3.027673
H          1.679287 -1.588738  2.320846
H         -0.404648 -2.953173  1.282363
H         -2.566843 -1.349660  1.347225
H         -1.838766  0.980533  2.452925
C          0.209440  0.077515 -2.541280
C          0.675872 -1.205136 -2.168991
C         -0.416389 -1.916055 -1.602956
C         -1.561610 -1.075627 -1.647933
C         -1.174865  0.150270 -2.229320
H          0.797468  0.852336 -3.027673
H          1.679287 -1.588738 -2.320846
H         -0.404648 -2.953173 -1.282363
H         -2.566843 -1.349660 -1.347225
H         -1.838766  0.980533 -2.452925
H         -1.552225  2.760218 -0.926742
H         -1.552225  2.760218  0.926742
C          0.359261  2.755000  0.000000
H          0.926506  2.821236 -0.930460
H          0.926506  2.821236  0.930460
