data_CrIn2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.53
_cell_length_b   6.53
_cell_length_c   3.65
_cell_angle_alpha   106.28
_cell_angle_beta   106.28
_cell_angle_gamma   124.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrIn2Bi
_chemical_formula_sum   'Cr1 In2 Bi1'
_cell_volume   102.86
_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
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  In  In2  1  0.53  0.89  0.0  1.0
  In  In3  1  0.53  0.11  0.0  1.0
  Bi  Bi0  1  0.05  0.0  0.0  1.0

data_CrIn2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.65
_cell_length_b   4.88
_cell_length_c   6.53
_cell_angle_alpha   111.89
_cell_angle_beta   106.15
_cell_angle_gamma   90.19
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrIn2Bi
_chemical_formula_sum   'Cr1 In2 Bi1'
_cell_volume   102.86
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.11  0.47  0.59  1.0
  In  In2  1  0.89  0.47  0.36  1.0
  Bi  Bi3  1  0.0  0.95  0.95  1.0

Cr In In Bi