data_In2SiBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.47
_cell_length_b   3.79
_cell_length_c   7.84
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2SiBi
_chemical_formula_sum   'In2 Si1 Bi1'
_cell_volume   103.06
_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  In1  1  0.0  0.0  0.1  1.0
  In  In2  1  0.74  0.89  0.23  1.0
  Si  Si3  1  0.0  0.0  0.88  1.0
  Bi  Bi0  1  0.74  0.89  0.54  1.0

data_In2SiBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.47
_cell_length_b   3.79
_cell_length_c   7.84
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2SiBi
_chemical_formula_sum   'In2 Si1 Bi1'
_cell_volume   103.06
_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  0.0  0.0  0.1  1.0
  In  In1  1  0.74  0.89  0.23  1.0
  Si  Si2  1  0.0  0.0  0.88  1.0
  Bi  Bi3  1  0.74  0.89  0.54  1.0

In In Si Bi
In In Si Bi 0 1 - - o 0 2 o o - 1 3 o o o 