23
cp2zrcl2_Cs_50.xyz                                
Zr         0.702816  0.000419  0.000000
Cl         2.260098 -0.005866 -1.908112
Cl         2.260098 -0.005866  1.908112
C          0.610420  2.472481 -0.704531
H          1.407621  2.836194 -1.344010
C          0.610420  2.472481  0.704531
H          1.407621  2.836194  1.344010
C         -0.594453  1.861422  1.146458
H         -0.892597  1.717407  2.180904
C         -0.594453  1.861422 -1.146458
H         -0.892597  1.717407 -2.180904
C         -1.347814  1.508195  0.000000
H         -2.336826  1.063999  0.000000
C          0.064035 -2.199557 -1.146049
H          0.372690 -2.333823 -2.177265
C         -1.138367 -1.597462 -0.712408
H         -1.937743 -1.236962 -1.352384
C         -1.138367 -1.597462  0.712408
H         -1.937743 -1.236962  1.352384
C          0.818726 -2.553574  0.000000
H          1.808559 -2.998981  0.000000
C          0.064035 -2.199557  1.146049
H          0.372690 -2.333823  2.177265
