data_ZnBiSb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.5
_cell_length_b   6.5
_cell_length_c   6.5
_cell_angle_alpha   145.32
_cell_angle_beta   136.98
_cell_angle_gamma   56.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnBiSb2
_chemical_formula_sum   'Zn1 Bi1 Sb2'
_cell_volume   105.75
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.0  0.73  1.0
  Sb  Sb1  1  0.94  0.0  0.26  1.0
  Sb  Sb2  1  0.0  0.38  0.47  1.0

data_ZnBiSb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.87
_cell_length_b   4.77
_cell_length_c   6.5
_cell_angle_alpha   111.51
_cell_angle_beta   107.34
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnBiSb2
_chemical_formula_sum   'Zn1 Bi1 Sb2'
_cell_volume   105.75
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.0  0.73  0.73  1.0
  Sb  Sb2  1  0.0  0.26  0.33  1.0
  Sb  Sb3  1  0.62  0.08  0.08  1.0

Zn Bi Sb Sb