# generated using pymatgen
data_ZrCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.10807121
_cell_length_b   3.24933218
_cell_length_c   5.43398339
_cell_angle_alpha   73.62687993
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCu
_chemical_formula_sum   'Zr2 Cu2'
_cell_volume   69.59388275
_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  0.75000000  0.64830044  0.19925602  1.0
  Zr  Zr1  1  0.25000000  0.35169956  0.80074398  1.0
  Cu  Cu2  1  0.75000000  0.93102683  0.64143297  1.0
  Cu  Cu3  1  0.25000000  0.06897317  0.35856703  1.0