38
cp2zrallyl_Et_back_cc260.xyz
Zr      -0.1970   0.0303   0.4796
C        2.2872   0.1670  -0.3664
H        2.3042   1.2601  -0.3053
C        2.2476  -0.5131   0.8292
C        1.7674   0.0303   2.0179
C        2.8180  -0.4120  -1.6160
H        2.4674  -1.5904   0.8047
H        1.8566  -0.5683   2.9254
H        1.8393   1.1170   2.1641
H        2.1850  -0.1976  -2.4944
H        3.8110   0.0241  -1.8353
H        2.9568  -1.5029  -1.5430
C       -0.0847  -2.4692   0.5721
C        0.1789  -2.0936  -0.7631
C       -0.9774  -1.5054  -1.2851
C       -1.9671  -1.5129  -0.2771
C       -1.4173  -2.1327   0.8537
H        0.5980  -2.9941   1.2448
H        1.1022  -2.2685  -1.3153
H       -1.1016  -1.1533  -2.3095
H       -2.9943  -1.1608  -0.3826
H       -1.9391  -2.3421   1.7895
C        0.2902   2.4743   0.0129
C       -0.0260   1.8319  -1.2094
C       -1.3808   1.4693  -1.1574
C       -1.8832   1.8150   0.1064
C       -0.8451   2.4642   0.8159
H        1.2454   2.9337   0.2776
H        0.6324   1.7293  -2.0732
H       -1.9563   1.0186  -1.9674
H       -2.9147   1.6942   0.4386
H       -0.9167   2.9044   1.8126
C       -0.5740  -0.1288   3.1369
C       -1.7453   0.2927   2.6122
H       -0.3516  -1.1949   3.2485
H        0.0604   0.5622   3.6952
H       -2.5208  -0.4078   2.2892
H       -2.0568   1.3335   2.7231
