data_MnSb3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.17
_cell_length_b   11.17
_cell_length_c   11.17
_cell_angle_alpha   158.22
_cell_angle_beta   158.22
_cell_angle_gamma   30.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnSb3
_chemical_formula_sum   'Mn2 Sb6'
_cell_volume   191.59
_cell_formula_units_Z   2
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  0.0  0.0  0.56  1.0
  Mn  Mn1  1  0.0  0.0  0.96  1.0
  Sb  Sb2  1  0.0  0.11  0.0  1.0
  Sb  Sb3  1  0.11  0.0  0.0  1.0
  Sb  Sb4  1  0.11  0.0  0.38  1.0
  Sb  Sb5  1  0.0  0.11  0.38  1.0
  Sb  Sb6  1  0.0  0.0  0.92  1.0
  Sb  Sb7  1  0.0  0.0  0.61  1.0

data_MnSb3
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.97
_cell_length_b   5.97
_cell_length_c   11.17
_cell_angle_alpha   90.0
_cell_angle_beta   105.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   MnSb3
_chemical_formula_sum   'Mn4 Sb12'
_cell_volume   383.17
_cell_formula_units_Z   4
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  0.0  0.0  0.04  1.0
  Mn  Mn1  2  0.0  0.0  0.44  1.0
  Sb  Sb2  4  0.05  0.05  0.11  1.0
  Sb  Sb3  4  0.05  0.05  0.73  1.0
  Sb  Sb4  2  0.0  0.0  0.08  1.0
  Sb  Sb5  2  0.0  0.0  0.39  1.0

Mn Mn Sb Sb Sb Sb Sb Sb
Mn Mn Sb Sb Sb Sb Sb Sb 0 7 o o o 1 6 o o o 2 6 o o - 3 6 o o - 4 5 o o o 