# generated using pymatgen
data_Pr7FeI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.02347043
_cell_length_b   10.02347043
_cell_length_c   10.02347092
_cell_angle_alpha   107.26695325
_cell_angle_beta   107.26695325
_cell_angle_gamma   107.26695037
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr7FeI12
_chemical_formula_sum   'Pr7 Fe1 I12'
_cell_volume   832.50434465
_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  0.80082200  0.52981400  0.59893600  1.0
  Pr  Pr1  1  0.52981400  0.59893600  0.80082200  1.0
  Pr  Pr2  1  0.19917800  0.47018600  0.40106400  1.0
  Pr  Pr3  1  0.47018600  0.40106400  0.19917800  1.0
  Pr  Pr4  1  0.00000000  0.00000000  0.00000000  1.0
  Pr  Pr5  1  0.59893600  0.80082200  0.52981400  1.0
  Pr  Pr6  1  0.40106400  0.19917800  0.47018600  1.0
  Fe  Fe7  1  0.50000000  0.50000000  0.50000000  1.0
  I  I8  1  0.72961600  0.18496700  0.57562100  1.0
  I  I9  1  0.97203900  0.89162100  0.65667200  1.0
  I  I10  1  0.57562100  0.72961600  0.18496700  1.0
  I  I11  1  0.10837900  0.34332800  0.02796100  1.0
  I  I12  1  0.65667200  0.97203900  0.89162100  1.0
  I  I13  1  0.89162100  0.65667200  0.97203900  1.0
  I  I14  1  0.02796100  0.10837900  0.34332800  1.0
  I  I15  1  0.81503300  0.42437900  0.27038400  1.0
  I  I16  1  0.34332800  0.02796100  0.10837900  1.0
  I  I17  1  0.27038400  0.81503300  0.42437900  1.0
  I  I18  1  0.18496700  0.57562100  0.72961600  1.0
  I  I19  1  0.42437900  0.27038400  0.81503300  1.0