# generated using pymatgen
data_Pr3ZnBr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.46319797
_cell_length_b   10.46319830
_cell_length_c   10.46319784
_cell_angle_alpha   109.47121975
_cell_angle_beta   109.47122038
_cell_angle_gamma   109.47122026
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3ZnBr3
_chemical_formula_sum   'Pr12 Zn4 Br12'
_cell_volume   881.80275866
_cell_formula_units_Z   4
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  0.48671669  0.49335834  0.24335834  1.0
  Pr  Pr1  1  0.75000000  0.24335834  0.25664166  1.0
  Pr  Pr2  1  0.75000000  0.00664166  0.49335834  1.0
  Pr  Pr3  1  0.24335834  0.48671669  0.49335834  1.0
  Pr  Pr4  1  0.25664166  0.75000000  0.24335834  1.0
  Pr  Pr5  1  0.01328331  0.25664166  0.00664166  1.0
  Pr  Pr6  1  0.00664166  0.01328331  0.25664166  1.0
  Pr  Pr7  1  0.49335834  0.75000000  0.00664166  1.0
  Pr  Pr8  1  0.49335834  0.24335834  0.48671669  1.0
  Pr  Pr9  1  0.00664166  0.49335834  0.75000000  1.0
  Pr  Pr10  1  0.25664166  0.00664166  0.01328331  1.0
  Pr  Pr11  1  0.24335834  0.25664166  0.75000000  1.0
  Zn  Zn12  1  0.25000000  0.25000000  0.25000000  1.0
  Zn  Zn13  1  0.50000000  0.00000000  0.25000000  1.0
  Zn  Zn14  1  0.00000000  0.25000000  0.50000000  1.0
  Zn  Zn15  1  0.25000000  0.50000000  0.00000000  1.0
  Br  Br16  1  0.25000000  0.75787927  0.74212073  1.0
  Br  Br17  1  0.51575754  0.50787927  0.75787927  1.0
  Br  Br18  1  0.98424246  0.74212073  0.99212073  1.0
  Br  Br19  1  0.74212073  0.25000000  0.75787927  1.0
  Br  Br20  1  0.99212073  0.98424246  0.74212073  1.0
  Br  Br21  1  0.25000000  0.99212073  0.50787927  1.0
  Br  Br22  1  0.75787927  0.51575754  0.50787927  1.0
  Br  Br23  1  0.50787927  0.25000000  0.99212073  1.0
  Br  Br24  1  0.75787927  0.74212073  0.25000000  1.0
  Br  Br25  1  0.74212073  0.99212073  0.98424246  1.0
  Br  Br26  1  0.99212073  0.50787927  0.25000000  1.0
  Br  Br27  1  0.50787927  0.75787927  0.51575754  1.0