data_[Gd4Pb1C2Cl1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Pb  2.3300  1.8000  1.1225
  C  2.5500  0.7000  0.3000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [3.6846]
_cell_length_b [3.6846]
_cell_length_c [14.9871]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Gd4PbC2Cl]
_chemical_formula_sum '[Gd4 Pb1 C2 Cl1]'
_cell_volume [176.2108]
_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
[
  Gd  Gd0  2  0.0000  0.0000  0.3558  1
  Gd  Gd1  2  0.3333  0.6667  0.1775  1
  Pb  Pb2  1  0.0000  0.0000  0.0000  1
  C  C3  2  0.6667  0.3333  0.2729  1
  Cl  Cl4  1  0.3333  0.6667  0.5000  1
]