data_Re2PPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.88
_cell_length_b   8.88
_cell_length_c   8.88
_cell_angle_alpha   19.46
_cell_angle_beta   19.46
_cell_angle_gamma   19.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re2PPb
_chemical_formula_sum   'Re2 P1 Pb1'
_cell_volume   67.93
_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
  Re  Re2  1  0.0  0.0  0.98  1.0
  Re  Re3  1  0.0  0.0  0.15  1.0
  P  P0  1  0.0  0.0  0.0  1.0
  Pb  Pb1  1  0.0  0.0  0.06  1.0

data_Re2PPb
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.2
_cell_length_b   3.0
_cell_length_c   8.88
_cell_angle_alpha   90.0
_cell_angle_beta   101.25
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Re2PPb
_chemical_formula_sum   'Re4 P2 Pb2'
_cell_volume   135.85
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Re  Re0  2  0.0  0.0  0.02  1.0
  Re  Re1  2  0.0  0.0  0.85  1.0
  P  P2  2  0.0  0.0  0.0  1.0
  Pb  Pb3  2  0.0  0.0  0.94  1.0

Re Re P Pb