40
piba_dih45.xyz
Zr      -0.0675   0.0885   0.0408
C        2.2045   0.2122  -0.1780
C        2.1344   1.5304   0.4742
H        2.8368  -0.5320   0.3232
H        2.4299   0.2477  -1.2533
H        1.0598   1.9372   0.5487
H        2.6095   2.3422  -0.1079
H        2.4932   1.5573   1.5136
C       -0.7014   2.6440  -0.7966
C       -1.8578   2.0291  -0.4870
H       -0.2587   3.2839  -0.0146
H       -2.3170   2.1969   0.4891
H       -2.4649   1.5220  -1.2407
C       -0.0438   2.7569  -2.1130
C        0.0926   4.2163  -2.4959
H       -0.6022   2.1997  -2.8847
H        0.9743   2.3126  -2.0668
H       -0.8972   4.6974  -2.5661
H        0.5947   4.3143  -3.4715
H        0.6880   4.7714  -1.7511
C       -0.1079   0.7334   2.4542
C        0.7864  -0.3502   2.3328
C        0.0484  -1.4758   1.9427
C       -1.3037  -1.0956   1.8242
C       -1.4000   0.2638   2.1450
H        0.1434   1.7429   2.7898
H        1.8547  -0.3378   2.5498
H        0.4531  -2.4789   1.7960
H       -2.1352  -1.7494   1.5608
H       -2.3255   0.8379   2.1971
C        0.2550  -0.5881  -2.3693
C        0.5995  -1.6842  -1.5472
C       -0.5732  -2.1263  -0.9152
C       -1.6338  -1.2830  -1.3047
C       -1.1162  -0.3633  -2.2354
H        0.9353  -0.0399  -3.0254
H        1.5846  -2.1432  -1.4686
H       -0.6590  -2.9950  -0.2606
H       -2.6806  -1.3912  -1.0191
H       -1.6952   0.3780  -2.7871
