# generated using pymatgen
data_SrPr6RuI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.05085664
_cell_length_b   10.05085621
_cell_length_c   10.05085813
_cell_angle_alpha   106.52212147
_cell_angle_beta   106.52211043
_cell_angle_gamma   106.52211816
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrPr6RuI12
_chemical_formula_sum   'Sr1 Pr6 Ru1 I12'
_cell_volume   856.36458219
_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
  Sr  Sr0  1  0.50000000  0.50000000  0.50000000  1.0
  Pr  Pr1  1  0.97788324  0.90255188  0.69774147  1.0
  Pr  Pr2  1  0.02211676  0.09744812  0.30225853  1.0
  Pr  Pr3  1  0.09744812  0.30225853  0.02211676  1.0
  Pr  Pr4  1  0.30225853  0.02211676  0.09744812  1.0
  Pr  Pr5  1  0.90255188  0.69774147  0.97788324  1.0
  Pr  Pr6  1  0.69774147  0.97788324  0.90255188  1.0
  Ru  Ru7  1  0.00000000  0.00000000  0.00000000  1.0
  I  I8  1  0.54228775  0.62542720  0.85508957  1.0
  I  I9  1  0.45771225  0.37457280  0.14491043  1.0
  I  I10  1  0.32114474  0.92540628  0.77209233  1.0
  I  I11  1  0.37457280  0.14491043  0.45771225  1.0
  I  I12  1  0.92540628  0.77209233  0.32114474  1.0
  I  I13  1  0.67885526  0.07459372  0.22790767  1.0
  I  I14  1  0.07459372  0.22790767  0.67885526  1.0
  I  I15  1  0.77209233  0.32114474  0.92540628  1.0
  I  I16  1  0.22790767  0.67885526  0.07459372  1.0
  I  I17  1  0.85508957  0.54228775  0.62542720  1.0
  I  I18  1  0.14491043  0.45771225  0.37457280  1.0
  I  I19  1  0.62542720  0.85508957  0.54228775  1.0