data_MnInCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.28
_cell_length_b   7.28
_cell_length_c   7.28
_cell_angle_alpha   154.89
_cell_angle_beta   154.89
_cell_angle_gamma   35.81
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnInCl
_chemical_formula_sum   'Mn1 In1 Cl1'
_cell_volume   69.46
_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  0.0  0.0  0.02  1.0
  In  In1  1  0.0  0.0  0.14  1.0
  Cl  Cl0  1  0.0  0.0  0.7  1.0

data_MnInCl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.48
_cell_length_b   4.48
_cell_length_c   7.28
_cell_angle_alpha   90.0
_cell_angle_beta   107.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   MnInCl
_chemical_formula_sum   'Mn2 In2 Cl2'
_cell_volume   138.92
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.02  0.0  0.02  1.0
  In  In1  2  0.14  0.0  0.14  1.0
  Cl  Cl2  2  0.2  0.5  0.7  1.0

Mn In Cl
Mn In Cl 0 1 o o o 0 2 o o - 