data_ZrInPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.72
_cell_length_b   11.72
_cell_length_c   11.72
_cell_angle_alpha   17.33
_cell_angle_beta   17.33
_cell_angle_gamma   17.33
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrInPb2
_chemical_formula_sum   'Zr1 In1 Pb2'
_cell_volume   124.58
_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
  Zr  Zr3  1  0.0  0.0  0.0  1.0
  In  In0  1  0.0  0.0  0.31  1.0
  Pb  Pb1  1  0.0  0.0  0.67  1.0
  Pb  Pb2  1  0.0  0.0  0.94  1.0

data_ZrInPb2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.12
_cell_length_b   3.53
_cell_length_c   11.72
_cell_angle_alpha   90.0
_cell_angle_beta   100.02
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZrInPb2
_chemical_formula_sum   'Zr2 In2 Pb4'
_cell_volume   249.16
_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
  Zr  Zr0  2  0.0  0.0  0.0  1.0
  In  In1  2  0.0  0.0  0.69  1.0
  Pb  Pb2  2  0.0  0.0  0.06  1.0
  Pb  Pb3  2  0.0  0.0  0.33  1.0

Zr In Pb Pb