# generated using pymatgen
data_Pr3Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.21642802
_cell_length_b   7.21642802
_cell_length_c   5.59781500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000022
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3Br
_chemical_formula_sum   'Pr6 Br2'
_cell_volume   252.46067613
_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  0.16948500  0.33897100  0.25000000  1.0
  Pr  Pr1  1  0.66102900  0.83051500  0.25000000  1.0
  Pr  Pr2  1  0.16948500  0.83051500  0.25000000  1.0
  Pr  Pr3  1  0.83051500  0.66102900  0.75000000  1.0
  Pr  Pr4  1  0.33897100  0.16948500  0.75000000  1.0
  Pr  Pr5  1  0.83051500  0.16948500  0.75000000  1.0
  Br  Br6  1  0.33333300  0.66666700  0.75000000  1.0
  Br  Br7  1  0.66666700  0.33333300  0.25000000  1.0