40
piba125_bu_et.xyz
Zr      -0.0795   0.0533   0.1363
C        1.9454   1.3768   0.6105
C        2.9974   1.7350  -0.4077
C        1.0727  -0.5736  -1.9852
C        0.1699   0.4480  -2.3155
C       -1.1321  -0.0298  -2.1009
C       -1.0306  -1.3530  -1.6389
C        0.3367  -1.6875  -1.5505
H        2.1625  -0.5153  -2.0639
H        0.4299   1.4409  -2.6890
H       -2.0585   0.5117  -2.2948
H       -1.8647  -2.0246  -1.4344
H        0.7495  -2.6567  -1.2676
C       -0.4459   0.1744   2.5898
C        0.2469  -1.0304   2.3469
C       -0.5883  -1.8670   1.5967
C       -1.8028  -1.1859   1.3765
C       -1.7179   0.0776   1.9955
H       -0.0776   1.0206   3.1775
H        1.2462  -1.2842   2.7098
H       -0.3556  -2.8777   1.2632
H       -2.6761  -1.5864   0.8609
H       -2.5167   0.8180   2.0419
H        2.5554   1.7653  -1.4242
H        3.3474   2.7625  -0.1879
H        2.3977   1.4729   1.6163
H        1.8991   0.2264   0.6024
C        0.7019   2.3930   0.6203
H        1.1985   3.1963   0.0516
H        0.6255   2.7222   1.6649
C       -0.7076   2.1654   0.0649
H       -0.8716   2.6259  -0.9173
H       -1.4481   2.5461   0.7804
C        4.1693   0.7955  -0.3831
H        4.6008   0.7841   0.6381
H        3.8167  -0.2384  -0.5750
C        5.2253   1.1748  -1.3856
H        4.8183   1.1655  -2.4122
H        5.6120   2.1904  -1.1918
H        6.0828   0.4832  -1.3591
