data_[As1P1Pb4Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  As  2.1800  1.1500  0.6600
  P  2.1900  1.0000  0.5500
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.4841]
_cell_length_b [4.3361]
_cell_length_c [7.6895]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0684]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [AsP(Pb2Cl)2]
_chemical_formula_sum '[As1 P1 Pb4 Cl2]'
_cell_volume [235.8444]
_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
[
  As  As0  1  0.5000  0.5000  0.0000  1.0
  P  P1  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb2  2  0.2336  0.5000  0.2159  1.0
  Pb  Pb3  2  0.2551  0.0000  0.7819  1.0
  Cl  Cl4  1  0.0000  0.5000  0.5000  1.0
  Cl  Cl5  1  0.5000  0.0000  0.5000  1.0
]