40
2etbu_cistrans100.xyz
Zr       0.0124  -0.1867   0.0017
C        2.2786  -0.1019  -0.0526
C        2.1136   1.3490  -0.0191
C        2.5015   2.0666  -1.3076
C        3.8735   2.6904  -1.2453
H        1.7728   2.8728  -1.5201
H        2.4376   1.3517  -2.1459
H        4.1332   3.1324  -2.2210
H        4.6488   1.9405  -1.0062
H        3.9322   3.4944  -0.4943
C        2.5589   2.0555   1.2364
C        1.9902   3.4401   1.3768
H        2.7120  -0.4990  -0.9831
H        2.7411  -0.5432   0.8439
H        0.9164   1.6081   0.0251
H        2.3013   1.4363   2.1133
H        3.6655   2.0864   1.2109
H        2.3255   3.9243   2.3085
H        2.2894   4.0933   0.5401
H        0.8837   3.4220   1.3874
C       -1.6322   0.3994   1.7349
C       -1.6349  -1.0090   1.6512
C       -0.3827  -1.4694   2.0883
C        0.4031  -0.3559   2.4349
C       -0.3771   0.8026   2.2249
H       -2.4733   1.0573   1.5100
H       -2.4745  -1.6353   1.3504
H       -0.0727  -2.5166   2.1538
H        1.4100  -0.3948   2.8524
H       -0.0764   1.8303   2.4499
C       -1.6523   0.7179  -1.5830
C       -1.8678  -0.6752  -1.5362
C       -0.7307  -1.3061  -2.0607
C        0.1918  -0.3087  -2.4491
C       -0.3916   0.9415  -2.1649
H       -2.3630   1.4890  -1.2824
H       -2.7704  -1.1746  -1.1830
H       -0.5954  -2.3852  -2.1755
H        1.1464  -0.4793  -2.9491
H        0.0465   1.9184  -2.3863
