43
cp2zr_me_C2Me4_infree.xyz                         
Zr        -0.010354  2.135818 -1.451368
C         -0.155224 -0.325083 -0.807148
C          0.029037 -0.578827 -2.351671
C         -0.021661  0.728004 -3.322999
H          0.635626  0.288981 -0.300354
H         -1.171546 -0.008446 -0.519942
H         -0.007935 -1.282849 -0.285489
C          2.127837  3.160667 -2.371369
C          2.562355  2.040514 -1.625877
C          2.264082  2.274232 -0.260046
C          1.643102  3.539287 -0.156170
C          1.561621  4.090329 -1.461124
H          2.251399  3.308298 -3.439835
H          3.092605  1.179988 -2.017262
H          2.519289  1.622102  0.572302
H          1.347536  4.029926  0.765332
H          1.212186  5.088066 -1.703922
C         -2.175789  3.105364 -2.372008
C         -2.574450  2.068123 -1.496978
C         -2.213663  2.441175 -0.176997
C         -1.590743  3.705695 -0.233016
C         -1.561116  4.116821 -1.590751
H         -2.355749  3.148846 -3.441201
H         -3.112739  1.166574 -1.774207
H         -2.412554  1.873248  0.728987
H         -1.248006  4.285010  0.617878
H         -1.219748  5.080427 -1.955442
C         -1.107219 -1.565545 -2.686663
H         -1.040494 -2.440335 -2.023668
H         -2.102982 -1.126527 -2.558989
H         -1.018618 -1.925091 -3.718693
C          1.354527 -1.349788 -2.476795
H          2.217662 -0.774775 -2.123403
H          1.300880 -2.265350 -1.868244
H          1.543691 -1.655884 -3.511921
C         -1.264509  0.751659 -4.230441
H         -2.228895  0.700606 -3.717805
H         -1.254021  1.668761 -4.834931
H         -1.236439 -0.083349 -4.951824
C          1.153833  0.774077 -4.311621
H          1.096527  1.697148 -4.905338
H          2.150253  0.724664 -3.864090
H          1.083316 -0.055657 -5.037948
