data_BaMn2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.25
_cell_length_b   3.5
_cell_length_c   7.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMn2Rh
_chemical_formula_sum   'Ba1 Mn2 Rh1'
_cell_volume   84.74
_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  0.62  0.75  0.44  1.0
  Mn  Mn1  1  0.0  0.0  0.7  1.0
  Mn  Mn2  1  0.62  0.75  0.88  1.0
  Rh  Rh3  1  0.0  0.0  0.18  1.0

data_BaMn2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   3.5
_cell_length_c   7.47
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaMn2Rh
_chemical_formula_sum   'Ba1 Mn2 Rh1'
_cell_volume   84.74
_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  0.62  0.75  0.44  1.0
  Mn  Mn1  1  0.0  0.0  0.7  1.0
  Mn  Mn2  1  0.62  0.75  0.88  1.0
  Rh  Rh3  1  0.0  0.0  0.18  1.0

Ba Mn Mn Rh
Ba Mn Mn Rh 0 3 o + o 0 3 + + o 0 1 o + o 0 1 + + o 1 2 - - o 2 3 + + + 2 3 o + + 