# generated using pymatgen
data_ZrCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.01216732
_cell_length_b   12.24424925
_cell_length_c   50.95509515
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCu
_chemical_formula_sum   'Zr24 Cu24'
_cell_volume   1879.31192989
_cell_formula_units_Z   24
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Zr  Zr1  1  0.521712  0.915846  0.302764  1
  Zr  Zr2  1  0.521712  0.300299  0.285585  1
  Zr  Zr3  1  0.521712  0.681134  0.267201  1
  Zr  Zr4  1  0.521712  0.760603  0.357906  1
  Zr  Zr5  1  0.521712  0.145368  0.338539  1
  Zr  Zr6  1  0.521712  0.530223  0.319917  1
  Zr  Zr7  1  0.521712  0.607484  0.413643  1
  Zr  Zr8  1  0.521712  0.992367  0.394869  1
  Zr  Zr9  1  0.521712  0.376596  0.376379  1
  Zr  Zr10  1  0.521712  0.453663  0.469286  1
  Zr  Zr11  1  0.521712  0.838345  0.450712  1
  Zr  Zr12  1  0.521712  0.222833  0.432198  1
  Zr  Zr13  1  0.521712  0.300042  0.525056  1
  Zr  Zr14  1  0.521712  0.684478  0.506554  1
  Zr  Zr15  1  0.521712  0.069200  0.487922  1
  Zr  Zr16  1  0.521712  0.146190  0.580792  1
  Zr  Zr17  1  0.521712  0.530258  0.562268  1
  Zr  Zr18  1  0.521712  0.915504  0.543520  1
  Zr  Zr19  1  0.521712  0.992762  0.637300  1
  Zr  Zr20  1  0.521712  0.378424  0.618730  1
  Zr  Zr21  1  0.521712  0.761366  0.599140  1
  Zr  Zr22  1  0.521712  0.840261  0.688465  1
  Zr  Zr23  1  0.521712  0.221713  0.671611  1
  Zr  Zr24  1  0.521712  0.607542  0.655120  1
  Cu  Cu25  1  1.021712  0.105705  0.291802  1
  Cu  Cu26  1  1.021712  0.488809  0.273746  1
  Cu  Cu27  1  1.021712  0.866968  0.259833  1
  Cu  Cu28  1  1.021712  0.953541  0.348803  1
  Cu  Cu29  1  1.021712  0.338665  0.330502  1
  Cu  Cu30  1  1.021712  0.725191  0.311508  1
  Cu  Cu31  1  1.021712  0.799811  0.404231  1
  Cu  Cu32  1  1.021712  0.184441  0.385593  1
  Cu  Cu33  1  1.021712  0.568354  0.367144  1
  Cu  Cu34  1  1.021712  0.646128  0.460103  1
  Cu  Cu35  1  1.021712  0.030602  0.441339  1
  Cu  Cu36  1  1.021712  0.414966  0.422691  1
  Cu  Cu37  1  1.021712  0.492138  0.515812  1
  Cu  Cu38  1  1.021712  0.876709  0.497102  1
  Cu  Cu39  1  1.021712  0.261453  0.478609  1
  Cu  Cu40  1  1.021712  0.338349  0.571705  1
  Cu  Cu41  1  1.021712  0.723051  0.552991  1
  Cu  Cu42  1  1.021712  0.107966  0.534520  1
  Cu  Cu43  1  1.021712  0.184876  0.626655  1
  Cu  Cu44  1  1.021712  0.569725  0.608820  1
  Cu  Cu45  1  1.021712  0.953967  0.590218  1
  Cu  Cu46  1  1.021712  0.033254  0.683547  1
  Cu  Cu47  1  1.021712  0.414719  0.664876  1
  Cu  Cu48  1  1.021712  0.797949  0.644401  1
