46
g_butyl_1B_cc350_IT27.xyz
Zr       0.0515  -0.0123  -0.1873
C        2.2772  -0.1830   0.2350
C        3.2805   0.9338   0.0710
C        3.5239   1.3671  -1.3496
C        4.5878   2.4253  -1.4586
H        2.3543  -0.5905   1.2649
H        2.5820  -1.0442  -0.4024
H        3.0106   1.8231   0.6751
H        4.2590   0.6057   0.4824
H        2.5814   1.7413  -1.7990
H        3.8146   0.4831  -1.9530
H        4.3158   3.3275  -0.8821
H        5.5461   2.0573  -1.0522
H        4.7659   2.7337  -2.5019
C        0.4645   0.2730  -2.7241
C       -0.8478   0.0030  -2.7344
H        0.7956   1.2867  -2.4198
H       -1.5968   0.7485  -2.4438
H       -1.2168  -0.9531  -3.1218
C        1.5186  -0.6216  -3.2327
C        2.2749   0.0612  -4.3548
H        2.2333  -0.8554  -2.4206
H        1.0780  -1.5757  -3.5752
H        2.7439   0.9972  -4.0049
H        3.0717  -0.5956  -4.7393
H        1.5977   0.3112  -5.1887
C        0.5279   2.4310   0.0948
C        0.4763   1.8550   1.3751
C       -0.8386   1.4018   1.5919
C       -1.5991   1.6913   0.4411
C       -0.7537   2.3370  -0.4771
H        1.4077   2.8893  -0.3653
H        1.3054   1.7875   2.0821
H       -1.2166   0.9455   2.5081
H       -2.6662   1.5022   0.3133
H       -1.0455   2.7317  -1.4544
C       -0.2930  -2.4224  -0.7345
C        0.4466  -2.3825   0.4571
C       -0.3626  -1.7973   1.4480
C       -1.6169  -1.5066   0.8727
C       -1.5739  -1.8856  -0.4720
H        0.0525  -2.8332  -1.6882
H        1.4639  -2.7494   0.5974
H       -0.0851  -1.6436   2.4935
H       -2.4775  -1.0833   1.3897
H       -2.4024  -1.8111  -1.1794
