40
2etbu_cistrans140.xyz
Zr      -0.0761   0.0332  -0.0020
C        2.1762   0.0020  -0.1299
C        2.0730   1.4856  -0.0471
C        2.5001   2.1961  -1.3481
C        3.3033   3.4646  -1.2233
H        1.6151   2.3872  -1.9807
H        3.1158   1.4651  -1.9037
H        3.6911   3.7460  -2.2165
H        4.1761   3.3460  -0.5606
H        2.7070   4.3176  -0.8624
C        2.6988   2.0130   1.2329
C        2.1463   3.3136   1.7440
H        2.5760  -0.3682  -1.0837
H        2.7163  -0.4374   0.7197
H        0.9573   1.8429   0.0935
H        2.5859   1.2321   2.0069
H        3.7887   2.0883   1.0555
H        2.6205   3.5982   2.6983
H        2.3034   4.1450   1.0403
H        1.0562   3.2371   1.9245
C       -1.3812   0.4021   2.0710
C       -1.7085  -0.8766   1.6057
C       -0.5480  -1.6774   1.6802
C        0.4907  -0.8933   2.2187
C       -0.0201   0.3991   2.4429
H       -2.0650   1.2514   2.1460
H       -2.6916  -1.2021   1.2655
H       -0.4853  -2.7378   1.4239
H        1.4953  -1.2422   2.4608
H        0.5228   1.2412   2.8822
C       -0.8903   0.7240  -2.2285
C       -1.8685  -0.1054  -1.6452
C       -1.3269  -1.4027  -1.5436
C       -0.0140  -1.3694  -2.0508
C        0.2521  -0.0569  -2.4758
H       -1.0107   1.7830  -2.4760
H       -2.8852   0.1870  -1.3771
H       -1.8518  -2.2863  -1.1770
H        0.6728  -2.2162  -2.1173
H        1.1810   0.2950  -2.9287
