# generated using pymatgen
data_Zr2CuRe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.83553392
_cell_length_b   10.83553392
_cell_length_c   10.83553392
_cell_angle_alpha   125.27529847
_cell_angle_beta   118.48831640
_cell_angle_gamma   86.87667795
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2CuRe
_chemical_formula_sum   'Zr2 Cu1 Re1'
_cell_volume   868.47227590
_cell_formula_units_Z   1
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  0.00000000  0.26855700  0.26855700  1.0
  Zr  Zr1  1  0.00000000  0.73144300  0.73144300  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re3  1  0.00000000  0.50000000  0.50000000  1.0