# generated using pymatgen
data_ZrCu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83264809
_cell_length_b   4.83264809
_cell_length_c   4.60751514
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   122.07901307
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCu2
_chemical_formula_sum   'Zr2 Cu4'
_cell_volume   91.17647200
_cell_formula_units_Z   2
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  Zr0  1  0.23396498  0.23396498  0.75000000  1.0
  Zr  Zr1  1  0.76603502  0.76603502  0.25000000  1.0
  Cu  Cu2  1  0.53396318  0.89571490  0.75000000  1.0
  Cu  Cu3  1  0.89571490  0.53396318  0.75000000  1.0
  Cu  Cu4  1  0.10428510  0.46603682  0.25000000  1.0
  Cu  Cu5  1  0.46603682  0.10428510  0.25000000  1.0