# generated using pymatgen
data_Pr4RuI5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.30386010
_cell_length_b   9.36166258
_cell_length_c   10.06524187
_cell_angle_alpha   103.95623770
_cell_angle_beta   102.34503386
_cell_angle_gamma   89.99999913
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr4RuI5
_chemical_formula_sum   'Pr4 Ru1 I5'
_cell_volume   383.90074481
_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  0.36025395  0.92693849  0.72050790  1.0
  Pr  Pr1  1  0.63974605  0.07306151  0.27949210  1.0
  Pr  Pr2  1  0.00008362  0.21368172  0.00016624  1.0
  Pr  Pr3  1  0.99991638  0.78631828  0.99983376  1.0
  Ru  Ru4  1  0.50000000  -0.00000000  0.00000000  1.0
  I  I5  1  0.50000000  0.50000000  0.00000000  1.0
  I  I6  1  0.17268515  0.83145011  0.34537029  1.0
  I  I7  1  0.82731485  0.16854989  0.65462971  1.0
  I  I8  1  0.83080112  0.65674165  0.66160323  1.0
  I  I9  1  0.16919888  0.34325835  0.33839677  1.0