data_MnCo2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.97
_cell_length_b   3.67
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCo2Sb
_chemical_formula_sum   'Mn1 Co2 Sb1'
_cell_volume   56.53
_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  0.4  1.0
  Co  Co0  1  0.0  0.0  0.02  1.0
  Co  Co1  1  0.48  0.83  0.37  1.0
  Sb  Sb3  1  0.48  0.83  0.99  1.0

data_MnCo2Sb
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.67
_cell_length_b   2.97
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   MnCo2Sb
_chemical_formula_sum   'Mn1 Co2 Sb1'
_cell_volume   56.53
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.4  1.0
  Co  Co1  1  0.0  0.0  0.02  1.0
  Co  Co2  1  0.83  0.5  0.37  1.0
  Sb  Sb3  1  0.83  0.5  0.99  1.0

Mn Co Co Sb
Mn Co Co Sb 0 2 - - o 0 2 o - o 1 3 - - - 1 3 o - - 