data_BaMn2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.21
_cell_length_b   6.21
_cell_length_c   6.21
_cell_angle_alpha   144.28
_cell_angle_beta   130.71
_cell_angle_gamma   62.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMn2Sb
_chemical_formula_sum   'Ba1 Mn2 Sb1'
_cell_volume   104.82
_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
  Ba  Ba0  1  0.0  0.59  0.48  1.0
  Mn  Mn1  1  0.0  0.0  0.25  1.0
  Mn  Mn2  1  0.9  0.0  0.98  1.0
  Sb  Sb3  1  0.0  0.0  0.91  1.0

data_BaMn2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.81
_cell_length_b   5.18
_cell_length_c   6.21
_cell_angle_alpha   114.64
_cell_angle_beta   107.86
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMn2Sb
_chemical_formula_sum   'Ba1 Mn2 Sb1'
_cell_volume   104.82
_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
  Ba  Ba0  1  0.52  0.11  0.11  1.0
  Mn  Mn1  1  0.75  0.75  0.75  1.0
  Mn  Mn2  1  0.92  0.02  0.92  1.0
  Sb  Sb3  1  0.09  0.09  0.09  1.0

Ba Mn Mn Sb