data_ZnIn2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59
_cell_length_b   5.59
_cell_length_c   5.83
_cell_angle_alpha   104.44
_cell_angle_beta   104.44
_cell_angle_gamma   36.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnIn2Pb
_chemical_formula_sum   'Zn1 In2 Pb1'
_cell_volume   103.88
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  In  In0  1  0.45  0.0  0.26  1.0
  In  In1  1  0.66  0.0  0.37  1.0
  Pb  Pb2  1  0.55  0.0  0.81  1.0

data_ZnIn2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.47
_cell_length_b   5.59
_cell_length_c   5.83
_cell_angle_alpha   104.44
_cell_angle_beta   90.0
_cell_angle_gamma   108.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnIn2Pb
_chemical_formula_sum   'Zn1 In2 Pb1'
_cell_volume   103.88
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.0  0.34  0.63  1.0
  In  In2  1  0.0  0.55  0.74  1.0
  Pb  Pb3  1  0.0  0.45  0.19  1.0

Zn In In Pb
Zn In In Pb 0 3 - o - 0 1 o o o 1 2 o o o 1 3 o o o 1 3 o o - 2 3 o o o 2 3 o o - 