data_InMoPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76
_cell_length_b   5.78
_cell_length_c   5.78
_cell_angle_alpha   37.09
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InMoPb2
_chemical_formula_sum   'In1 Mo1 Pb2'
_cell_volume   96.07
_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
  In  In0  1  0.38  0.0  0.35  1.0
  Mo  Mo1  1  0.0  0.0  0.87  1.0
  Pb  Pb2  1  0.38  0.0  0.34  1.0
  Pb  Pb3  1  0.0  0.0  0.9  1.0

data_InMoPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.68
_cell_length_b   4.76
_cell_length_c   5.78
_cell_angle_alpha   90.0
_cell_angle_beta   108.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InMoPb2
_chemical_formula_sum   'In1 Mo1 Pb2'
_cell_volume   96.07
_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
  In  In0  1  0.65  0.38  0.65  1.0
  Mo  Mo1  1  0.13  0.0  0.13  1.0
  Pb  Pb2  1  0.1  0.0  0.1  1.0
  Pb  Pb3  1  0.66  0.38  0.66  1.0

In Mo Pb Pb