# generated using pymatgen
data_Pr2Cu2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19064458
_cell_length_b   4.19064432
_cell_length_c   16.55648231
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr2Cu2Br
_chemical_formula_sum   'Pr4 Cu4 Br2'
_cell_volume   251.80264468
_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
  Pr  Pr0  1  0.00000000  0.00000000  0.10831185  1.0
  Pr  Pr1  1  0.00000000  0.00000000  0.89168815  1.0
  Pr  Pr2  1  0.00000000  0.00000000  0.60831185  1.0
  Pr  Pr3  1  0.00000000  0.00000000  0.39168815  1.0
  Cu  Cu4  1  0.33333300  0.66666700  0.50120895  1.0
  Cu  Cu5  1  0.66666700  0.33333300  0.49879105  1.0
  Cu  Cu6  1  0.66666700  0.33333300  0.00120895  1.0
  Cu  Cu7  1  0.33333300  0.66666700  0.99879105  1.0
  Br  Br8  1  0.33333300  0.66666700  0.25000000  1.0
  Br  Br9  1  0.66666700  0.33333300  0.75000000  1.0