47
cp2zr_ibume_alme2_Cs_2.xyz                        
Zr         1.389283  0.087161  0.000000
C          1.275267  0.236839 -2.557749
C          1.685537 -1.084457 -2.258818
C          2.955140 -1.027229 -1.638727
C          3.349702  0.337361 -1.585532
C          2.314902  1.112973 -2.154508
H          0.356005  0.525080 -3.057372
H          1.138782 -1.994460 -2.492692
H          3.558887 -1.879076 -1.344723
H          4.310264  0.708271 -1.243517
H          2.332690  2.189472 -2.297230
C          1.275267  0.236839  2.557749
C          2.314902  1.112973  2.154508
C          3.349702  0.337361  1.585532
C          2.955140 -1.027229  1.638727
C          1.685537 -1.084457  2.258818
H          0.356005  0.525080  3.057372
H          2.332690  2.189472  2.297230
H          4.310264  0.708271  1.243517
H          3.558887 -1.879076  1.344723
H          1.138782 -1.994460  2.492692
C         -0.822073 -0.879360  0.000000
H         -0.348873 -1.314709 -0.901110
H         -0.348873 -1.314709  0.901110
Al        -1.416750  1.192280  0.000000
C         -2.279909  1.642388  1.723765
H         -1.681452  1.419999  2.618271
H         -2.512360  2.718687  1.754162
H         -3.241641  1.120895  1.844041
C         -2.279909  1.642388 -1.723765
H         -1.681452  1.419999 -2.618271
H         -3.241641  1.120895 -1.844041
H         -2.512360  2.718687 -1.754162
C          0.502264  2.338545  0.000000
H          1.585437  2.570247  0.000000
H          0.137921  2.862415 -0.897733
H          0.137921  2.862415  0.897733
C         -2.305437 -1.409683  0.000000
H         -3.000692 -0.549495  0.000000
C         -2.612136 -2.208011  1.267475
H         -3.673492 -2.490847  1.291226
H         -2.018640 -3.133580  1.296596
H         -2.402318 -1.624267  2.173009
C         -2.612136 -2.208011 -1.267475
H         -2.018640 -3.133580 -1.296596
H         -3.673492 -2.490847 -1.291226
H         -2.402318 -1.624267 -2.173009
