# generated using pymatgen
data_Pr4PIrBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.18325640
_cell_length_b   4.18325659
_cell_length_c   15.34737131
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001431
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr4PIrBr2
_chemical_formula_sum   'Pr4 P1 Ir1 Br2'
_cell_volume   232.59134900
_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
  Pr  Pr0  1  0.33333300  0.66666700  0.09875880  1.0
  Pr  Pr1  1  0.66666700  0.33333300  0.59756257  1.0
  Pr  Pr2  1  0.66666700  0.33333300  0.90124120  1.0
  Pr  Pr3  1  0.33333300  0.66666700  0.40243743  1.0
  P  P4  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir5  1  0.00000000  0.00000000  0.50000000  1.0
  Br  Br6  1  0.66666700  0.33333300  0.23822384  1.0
  Br  Br7  1  0.33333300  0.66666700  0.76177616  1.0