# generated using pymatgen
data_Pr3GaI3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.94918336
_cell_length_b   10.94918413
_cell_length_c   10.94918455
_cell_angle_alpha   109.47121958
_cell_angle_beta   109.47122100
_cell_angle_gamma   109.47122143
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3GaI3
_chemical_formula_sum   'Pr12 Ga4 I12'
_cell_volume   1010.46987900
_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  0.02918719  0.26459460  0.01459460  1.0
  Pr  Pr1  1  0.75000000  0.01459460  0.48540540  1.0
  Pr  Pr2  1  0.26459460  0.75000000  0.23540540  1.0
  Pr  Pr3  1  0.48540540  0.75000000  0.01459460  1.0
  Pr  Pr4  1  0.75000000  0.23540540  0.26459460  1.0
  Pr  Pr5  1  0.01459460  0.48540540  0.75000000  1.0
  Pr  Pr6  1  0.23540540  0.26459460  0.75000000  1.0
  Pr  Pr7  1  0.48540540  0.23540540  0.47081281  1.0
  Pr  Pr8  1  0.47081281  0.48540540  0.23540540  1.0
  Pr  Pr9  1  0.26459460  0.01459460  0.02918719  1.0
  Pr  Pr10  1  0.01459460  0.02918719  0.26459460  1.0
  Pr  Pr11  1  0.23540540  0.47081281  0.48540540  1.0
  Ga  Ga12  1  0.50000000  0.00000000  0.25000000  1.0
  Ga  Ga13  1  0.25000000  0.50000000  0.00000000  1.0
  Ga  Ga14  1  0.25000000  0.25000000  0.25000000  1.0
  Ga  Ga15  1  0.00000000  0.25000000  0.50000000  1.0
  I  I16  1  0.75779093  0.74220907  0.25000000  1.0
  I  I17  1  0.99220907  0.50779093  0.25000000  1.0
  I  I18  1  0.25000000  0.75779093  0.74220907  1.0
  I  I19  1  0.75779093  0.51558285  0.50779093  1.0
  I  I20  1  0.50779093  0.25000000  0.99220907  1.0
  I  I21  1  0.74220907  0.99220907  0.98441715  1.0
  I  I22  1  0.99220907  0.98441715  0.74220907  1.0
  I  I23  1  0.51558285  0.50779093  0.75779093  1.0
  I  I24  1  0.25000000  0.99220907  0.50779093  1.0
  I  I25  1  0.74220907  0.25000000  0.75779093  1.0
  I  I26  1  0.50779093  0.75779093  0.51558285  1.0
  I  I27  1  0.98441715  0.74220907  0.99220907  1.0