data_Sc3Bi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.1
_cell_length_b   6.17
_cell_length_c   9.17
_cell_angle_alpha   60.03
_cell_angle_beta   41.29
_cell_angle_gamma   78.69
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Bi2
_chemical_formula_sum   'Sc6 Bi4'
_cell_volume   248.55
_cell_formula_units_Z   2
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
  Sc  Sc4  1  0.93  0.02  0.55  1.0
  Sc  Sc5  1  0.7  0.92  0.55  1.0
  Sc  Sc6  1  0.58  0.65  0.12  1.0
  Sc  Sc7  1  0.36  0.75  0.12  1.0
  Sc  Sc8  1  0.32  0.47  0.89  1.0
  Sc  Sc9  1  0.66  0.73  0.19  1.0
  Bi  Bi0  1  0.1  0.25  0.89  1.0
  Bi  Bi1  1  0.53  0.69  0.89  1.0
  Bi  Bi2  1  0.76  0.96  0.33  1.0
  Bi  Bi3  1  0.88  0.98  0.33  1.0

data_Sc3Bi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.17
_cell_length_b   6.17
_cell_length_c   8.1
_cell_angle_alpha   101.31
_cell_angle_beta   101.31
_cell_angle_gamma   119.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Bi2
_chemical_formula_sum   'Sc6 Bi4'
_cell_volume   248.55
_cell_formula_units_Z   2
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
  Sc  Sc0  1  0.02  0.45  0.52  1.0
  Sc  Sc1  1  0.47  0.11  0.8  1.0
  Sc  Sc2  1  0.65  0.88  0.3  1.0
  Sc  Sc3  1  0.73  0.81  0.15  1.0
  Sc  Sc4  1  0.75  0.88  0.52  1.0
  Sc  Sc5  1  0.92  0.45  0.74  1.0
  Bi  Bi6  1  0.25  0.11  0.01  1.0
  Bi  Bi7  1  0.69  0.11  0.57  1.0
  Bi  Bi8  1  0.96  0.67  0.92  1.0
  Bi  Bi9  1  0.98  0.67  0.8  1.0

Sc Sc Sc Sc Sc Sc Bi Bi Bi Bi