38
cp2zrallyl_Et_cc180.xyz
Zr       0.0277  -0.1057   0.0423
C        2.2478   0.4328   0.1658
C        1.8993   1.8626   0.1454
C        0.4132   2.6019  -0.5509
H        0.3820   2.3357  -1.6237
C       -0.8225   2.2556   0.1331
C       -1.8761   1.6192  -0.4236
C        0.7353   4.0599  -0.3689
H       -0.8732   2.5535   1.1936
H       -2.7724   1.4055   0.1643
H       -1.9508   1.4923  -1.5056
H        1.6870   4.3166  -0.8633
H       -0.0653   4.6851  -0.8000
H        0.8263   4.3134   0.7015
C        0.1462   0.1681   2.5219
C        0.7861  -1.0484   2.2138
C       -0.1752  -1.9198   1.6858
C       -1.4192  -1.2484   1.6714
C       -1.2185   0.0280   2.2120
H        0.6189   1.0433   2.9772
H        1.8310  -1.2944   2.3957
H        0.0001  -2.9571   1.3983
H       -2.3726  -1.6676   1.3485
H       -1.9947   0.7787   2.3733
C       -0.3720  -0.2052  -2.4366
C        0.9321  -0.6720  -2.2385
C        0.8641  -1.8574  -1.4879
C       -0.4987  -2.1398  -1.2565
C       -1.2633  -1.1101  -1.8183
H       -0.6506   0.6727  -3.0251
H        1.8422  -0.1999  -2.6127
H        1.7123  -2.4712  -1.1806
H       -0.8977  -3.0237  -0.7585
H       -2.3528  -1.0568  -1.8306
H        2.7222   0.1371   1.1072
H        2.8498   0.1043  -0.6888
H        1.8974   2.3307   1.1424
H        2.5700   2.4308  -0.5196
