data_MgIn2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85
_cell_length_b   5.85
_cell_length_c   5.62
_cell_angle_alpha   101.06
_cell_angle_beta   101.06
_cell_angle_gamma   34.94
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgIn2Pb
_chemical_formula_sum   'Mg1 In2 Pb1'
_cell_volume   107.92
_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
  Mg  Mg2  1  0.0  0.0  0.0  1.0
  In  In0  1  1.0  0.0  0.2  1.0
  In  In1  1  0.03  0.0  0.31  1.0
  Pb  Pb3  1  0.01  0.0  0.75  1.0

data_MgIn2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.51
_cell_length_b   5.62
_cell_length_c   5.85
_cell_angle_alpha   101.06
_cell_angle_beta   107.47
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgIn2Pb
_chemical_formula_sum   'Mg1 In2 Pb1'
_cell_volume   107.92
_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
  Mg  Mg0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.0  0.2  1.0  1.0
  In  In2  1  0.0  0.31  0.03  1.0
  Pb  Pb3  1  0.0  0.75  0.01  1.0

Mg In In Pb