43
cp2zr_Me_1Hex_ALLYL12_ch145.xyz                   
Zr         0.001774  2.393781  0.556496
C          0.009246 -0.025178 -0.006031
C         -1.209185  1.736787  2.815364
C         -0.846402  3.119240  2.656490
H          0.547347  0.621894 -0.706836
H          0.602195 -0.950529 -0.080596
H         -1.004169 -0.272050 -0.314171
C         -2.395070  2.357100 -0.412509
C         -1.592248  1.896810 -1.483087
C         -0.701331  2.919333 -1.849477
C         -0.984233  4.055294 -1.034290
C         -2.041666  3.711083 -0.162423
H         -3.205134  1.802624  0.055105
H         -1.655833  0.925034 -1.962994
H          0.008321  2.867364 -2.670062
H         -0.528866  5.034683 -1.134981
H         -2.536058  4.380082  0.530336
C          2.199840  2.986350  1.736420
C          2.472628  1.796993  1.026988
C          2.374021  2.083030 -0.362613
C          2.052722  3.449461 -0.504158
C          1.913861  4.006900  0.791968
H          2.247330  3.108863  2.813129
H          2.764384  0.840533  1.454309
H          2.597839  1.393141 -1.172459
H          1.970248  3.981333 -1.446007
H          1.697502  5.046094  1.015492
C         -0.337873  0.718315  3.125976
H          0.014050 -0.033217  1.443943
H          0.675392  0.992346  3.436600
H         -2.239169  1.449339  2.576752
H         -0.014078  3.464434  3.271401
H         -1.678520  3.820999  2.640003
C         -0.713225 -0.736104  3.346579
H         -1.595126 -0.774324  4.008162
H         -1.047670 -1.235301  2.415416
C          0.437004 -1.543110  3.960002
H          1.303702 -1.520894  3.278085
H          0.756935 -1.038773  4.885311
C          0.072941 -2.992628  4.269815
H          0.905458 -3.497176  4.778144
H         -0.802560 -3.048966  4.931493
H         -0.154456 -3.560875  3.356523
