data_[Pr6Os1I10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Os  2.2000  1.3000  0.6730
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [8.0729]
_cell_length_b [10.0375]
_cell_length_c [10.1751]
_cell_angle_alpha [107.7233]
_cell_angle_beta [97.4178]
_cell_angle_gamma [105.1666]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Pr6OsI10]
_chemical_formula_sum '[Pr6 Os1 I10]'
_cell_volume [738.2153]
_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  2  0.1388  0.3671  0.3267  1.0
  Pr  Pr1  2  0.3835  0.4580  0.7478  1.0
  Pr  Pr2  2  0.4704  0.7750  0.5810  1.0
  Os  Os3  1  0.5000  0.5000  0.5000  1.0
  I  I4  2  0.0493  0.6839  0.4106  1.0
  I  I5  2  0.1465  0.0435  0.2256  1.0
  I  I6  2  0.2359  0.4098  0.0387  1.0
  I  I7  2  0.2926  0.7625  0.8486  1.0
  I  I8  2  0.4135  0.1312  0.6783  1.0
]