data_[Pr12Co4P2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Co  1.8800  1.3500  0.7683
  P  2.1900  1.0000  0.5500
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1273]
_cell_length_b [12.3474]
_cell_length_c [7.8086]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.6960]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr6Co2PCl3]
_chemical_formula_sum '[Pr12 Co4 P2 Cl6]'
_cell_volume [654.6698]
_cell_formula_units_Z [2]
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  8  0.2419  0.1738  0.2034  1.0
  Pr  Pr1  4  0.2198  0.5000  0.2033  1.0
  Co  Co2  4  0.0000  0.3330  0.0000  1.0
  P  P3  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl4  4  0.0000  0.1632  0.5000  1.0
  Cl  Cl5  2  0.0000  0.5000  0.5000  1.0
]