49
cp2zrcl2_2tma_Cs.xyz
Al       4.3081   0.0646   0.0000
Al      -2.7074   2.8447   0.0000
C        5.5170  -1.5232   0.0000
H        6.5695  -1.1910   0.0000
H        5.3835  -2.1574   0.8897
H        5.3835  -2.1574  -0.8897
C        3.9794   1.0149   1.7204
H        3.8713   0.3259   2.5716
H        4.8437   1.6638   1.9459
H        3.0933   1.6660   1.6882
C        3.9794   1.0149  -1.7204
H        3.8713   0.3259  -2.5716
H        3.0933   1.6660  -1.6882
H        4.8437   1.6638  -1.9459
C       -1.4656   4.3993   0.0000
H       -0.8162   4.4201   0.8883
H       -0.8162   4.4201  -0.8883
H       -2.0399   5.3414   0.0000
C       -3.6322   2.3561  -1.7027
H       -4.1473   1.3839  -1.6697
H       -4.4146   3.1120  -1.8956
H       -2.9681   2.3712  -2.5802
C       -3.6322   2.3561   1.7027
H       -2.9681   2.3712   2.5802
H       -4.4146   3.1120   1.8956
H       -4.1473   1.3839   1.6697
Zr      -0.4524  -1.4331   0.0000
Cl       2.0429  -1.6005   0.0000
Cl      -0.6965   1.0623   0.0000
C       -2.2125  -2.2533  -1.6147
H       -3.2370  -2.3943  -1.2865
C       -1.1857  -3.2401  -1.6037
H       -1.2903  -4.2662  -1.2676
C       -0.0296  -2.6697  -2.1854
H        0.9283  -3.1632  -2.3147
C       -1.6829  -1.0811  -2.2026
H       -2.2159  -0.1478  -2.3526
C       -0.3280  -1.3298  -2.5374
H        0.3635  -0.6160  -2.9750
C       -0.0296  -2.6697   2.1854
H        0.9283  -3.1632   2.3147
C       -1.1857  -3.2401   1.6037
H       -1.2903  -4.2662   1.2676
C       -2.2125  -2.2533   1.6147
H       -3.2370  -2.3943   1.2865
C       -0.3280  -1.3298   2.5374
H        0.3635  -0.6160   2.9750
C       -1.6829  -1.0811   2.2026
H       -2.2159  -0.1478   2.3526
