40
1etbu_dih100.xyz
Zr      -0.0709  -0.0761   0.1201
C        2.1815   0.2548   0.0575
C        1.7953   1.6824  -0.1235
C        1.8152   2.2767  -1.5096
C        1.1388   3.6164  -1.5768
H        2.3101   2.3353   0.6083
H        0.7015   1.8931   0.2456
H        1.3622   1.5753  -2.2301
H        2.8770   2.3692  -1.8136
H        1.2007   4.0549  -2.5857
H        1.5992   4.3337  -0.8752
H        0.0665   3.5405  -1.3140
C        3.2045   0.0233   1.1350
C        4.5477   0.5926   0.7469
H        2.5619  -0.1537  -0.8962
H        3.3133  -1.0598   1.3276
H        2.8725   0.4810   2.0871
H        5.2990   0.4465   1.5410
H        4.9282   0.1128  -0.1718
H        4.4823   1.6785   0.5496
C        0.1965   0.4811   2.5305
C       -1.1748   0.6118   2.2366
C       -1.6680  -0.6497   1.8754
C       -0.5965  -1.5691   1.9520
C        0.5534  -0.8689   2.3659
H        0.8576   1.2884   2.8559
H       -1.7558   1.5368   2.2882
H       -2.7020  -0.8879   1.6231
H       -0.6656  -2.6468   1.7928
H        1.5388  -1.2992   2.5524
C       -0.7729   0.0035  -2.2401
C       -1.7736  -0.6930  -1.5291
C       -1.2222  -1.9053  -1.0846
C        0.1223  -1.9568  -1.5053
C        0.3911  -0.7854  -2.2318
H       -0.8989   0.9633  -2.7511
H       -2.8082  -0.3719  -1.3904
H       -1.7560  -2.6838  -0.5383
H        0.8232  -2.7755  -1.3269
H        1.3355  -0.5440  -2.7225
