data_Mn2CdCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.05
_cell_length_b   4.39
_cell_length_c   5.71
_cell_angle_alpha   90.0
_cell_angle_beta   104.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CdCl
_chemical_formula_sum   'Mn2 Cd1 Cl1'
_cell_volume   73.98
_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
  Mn  Mn2  1  0.07  0.19  0.37  1.0
  Mn  Mn3  1  0.97  0.0  0.19  1.0
  Cd  Cd0  1  0.42  0.19  0.57  1.0
  Cl  Cl1  1  0.04  0.0  0.68  1.0

data_Mn2CdCl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   4.39
_cell_length_c   5.71
_cell_angle_alpha   90.0
_cell_angle_beta   104.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CdCl
_chemical_formula_sum   'Mn2 Cd1 Cl1'
_cell_volume   73.98
_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
  Mn  Mn0  1  0.07  0.19  0.37  1.0
  Mn  Mn1  1  0.97  0.0  0.19  1.0
  Cd  Cd2  1  0.42  0.19  0.57  1.0
  Cl  Cl3  1  0.04  0.0  0.68  1.0

Mn Mn Cd Cl
Mn Mn Cd Cl 0 1 - o o 0 2 o o o 0 3 o o o 2 3 + o o 2 3 o o o 