data_CoSbCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43
_cell_length_b   5.18
_cell_length_c   4.52
_cell_angle_alpha   67.78
_cell_angle_beta   61.89
_cell_angle_gamma   50.34
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoSbCl2
_chemical_formula_sum   'Co1 Sb1 Cl2'
_cell_volume   85.81
_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
  Co  Co2  1  0.0  0.0  0.0  1.0
  Sb  Sb3  1  0.98  0.4  0.24  1.0
  Cl  Cl0  1  0.98  0.7  0.12  1.0
  Cl  Cl1  1  0.0  0.7  0.12  1.0

data_CoSbCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.52
_cell_length_b   4.52
_cell_length_c   5.18
_cell_angle_alpha   112.22
_cell_angle_beta   112.22
_cell_angle_gamma   97.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoSbCl2
_chemical_formula_sum   'Co1 Sb1 Cl2'
_cell_volume   85.81
_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
  Co  Co0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.4  0.62  0.38  1.0
  Cl  Cl2  1  0.7  0.8  0.68  1.0
  Cl  Cl3  1  0.7  0.82  0.7  1.0

Co Sb Cl Cl
Co Sb Cl Cl 0 3 o - o 0 2 - - o 1 3 + o o 1 2 o o o 2 3 + o o 