data_NiSbCl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.9
_cell_length_b   3.3
_cell_length_c   5.21
_cell_angle_alpha   90.0
_cell_angle_beta   108.3
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiSbCl2
_chemical_formula_sum   'Ni1 Sb1 Cl2'
_cell_volume   80.07
_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
  Ni  Ni2  1  0.0  0.0  0.0  1.0
  Sb  Sb3  1  0.63  0.0  0.47  1.0
  Cl  Cl0  1  0.67  0.65  0.96  1.0
  Cl  Cl1  1  0.59  0.65  0.99  1.0

data_NiSbCl2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.3
_cell_length_b   4.9
_cell_length_c   5.21
_cell_angle_alpha   108.3
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiSbCl2
_chemical_formula_sum   'Ni1 Sb1 Cl2'
_cell_volume   80.07
_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
  Ni  Ni0  1  0.0  0.0  0.0  1.0
  Sb  Sb1  1  0.0  0.37  0.53  1.0
  Cl  Cl2  1  0.35  0.33  0.04  1.0
  Cl  Cl3  1  0.35  0.41  0.01  1.0

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