data_[Sr12Bi6P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Bi  2.0200  1.6000  1.0350
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.1118]
_cell_length_b [8.7149]
_cell_length_c [14.0847]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6007]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sr6Bi3P]
_chemical_formula_sum '[Sr12 Bi6 P2]'
_cell_volume [819.5845]
_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
[
  Sr  Sr0  4  0.1024  0.5637  0.7382  1.0
  Sr  Sr1  4  0.2439  0.2025  0.5709  1.0
  Sr  Sr2  4  0.3643  0.6778  0.5615  1.0
  Bi  Bi3  4  0.2794  0.5790  0.2532  1.0
  Bi  Bi4  2  0.5000  0.0000  0.5000  1.0
  P  P5  2  0.0000  0.0000  0.0000  1.0
]