data_CaBi2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.6
_cell_length_b   6.6
_cell_length_c   6.6
_cell_angle_alpha   142.56
_cell_angle_beta   134.4
_cell_angle_gamma   60.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaBi2Sb
_chemical_formula_sum   'Ca1 Bi2 Sb1'
_cell_volume   123.39
_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
  Ca  Ca2  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.56  0.52  1.0
  Bi  Bi1  1  0.12  0.0  0.18  1.0
  Sb  Sb3  1  0.0  0.0  0.7  1.0

data_CaBi2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.23
_cell_length_b   5.11
_cell_length_c   6.6
_cell_angle_alpha   112.8
_cell_angle_beta   108.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaBi2Sb
_chemical_formula_sum   'Ca1 Bi2 Sb1'
_cell_volume   123.39
_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
  Ca  Ca0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.48  0.04  0.04  1.0
  Bi  Bi2  1  0.93  0.82  0.93  1.0
  Sb  Sb3  1  0.3  0.3  0.3  1.0

Ca Bi Bi Sb