# generated using pymatgen
data_Cu(ReO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.66572083
_cell_length_b   5.66572142
_cell_length_c   6.30044630
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001174
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu(ReO4)2
_chemical_formula_sum   'Cu1 Re2 O8'
_cell_volume   175.15086349
_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
  Cu  Cu0  1  0.00000000  0.00000000  0.00000000  1.0
  Re  Re1  1  0.33333300  0.66666700  0.27918839  1.0
  Re  Re2  1  0.66666700  0.33333300  0.72081161  1.0
  O  O3  1  0.66666700  0.33333300  0.44700239  1.0
  O  O4  1  0.33333300  0.66666700  0.55299761  1.0
  O  O5  1  0.81460711  0.14576230  0.81121438  1.0
  O  O6  1  0.14576230  0.33115619  0.18878562  1.0
  O  O7  1  0.66884381  0.81460711  0.18878562  1.0
  O  O8  1  0.18539289  0.85423770  0.18878562  1.0
  O  O9  1  0.85423770  0.66884381  0.81121438  1.0
  O  O10  1  0.33115619  0.18539289  0.81121438  1.0