46
g_butyl_1B_cc350_IT20.xyz
Zr       0.0359  -0.0160  -0.1877
C        2.2677  -0.1679   0.1953
C        3.2790   0.9461   0.0595
C        3.5464   1.3743  -1.3579
C        4.6295   2.4133  -1.4641
H        2.2628  -0.5038   1.2562
H        2.6447  -1.0579  -0.3556
H        2.9914   1.8366   0.6523
H        4.2480   0.6206   0.4947
H        2.6121   1.7660  -1.8123
H        3.8217   0.4859  -1.9622
H        4.3740   3.3228  -0.8918
H        5.5814   2.0288  -1.0585
H        4.8138   2.7130  -2.5089
C        0.4542   0.2896  -2.7630
C       -0.8497  -0.0230  -2.7176
H        0.7727   1.3069  -2.4645
H       -1.6097   0.7028  -2.4011
H       -1.2048  -0.9898  -3.0913
C        1.5198  -0.5922  -3.2639
C        2.3145   0.0910  -4.3559
H        2.2023  -0.8325  -2.4238
H        1.0868  -1.5463  -3.6169
H        2.7773   1.0215  -3.9841
H        3.1217  -0.5671  -4.7146
H        1.6690   0.3466  -5.2128
C        0.5482   2.4129   0.1219
C        0.4507   1.8354   1.3986
C       -0.8760   1.4051   1.5809
C       -1.5988   1.7097   0.4114
C       -0.7172   2.3414  -0.4835
H        1.4455   2.8572  -0.3152
H        1.2649   1.7482   2.1202
H       -1.2828   0.9531   2.4867
H       -2.6645   1.5355   0.2559
H       -0.9828   2.7468  -1.4645
C       -0.3141  -2.4385  -0.7174
C        0.4549  -2.3881   0.4553
C       -0.3325  -1.7970   1.4601
C       -1.5999  -1.5140   0.9122
C       -1.5880  -1.8983  -0.4284
H        0.0069  -2.8610  -1.6741
H        1.4759  -2.7528   0.5737
H       -0.0307  -1.6398   2.4986
H       -2.4499  -1.0898   1.4472
H       -2.4288  -1.8226  -1.1212
