data_Mn2OsRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.64
_cell_length_b   2.64
_cell_length_c   8.72
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   117.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2OsRh
_chemical_formula_sum   'Mn2 Os1 Rh1'
_cell_volume   54.0
_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  Mn0  1  0.38  0.0  0.65  1.0
  Mn  Mn1  1  0.0  0.0  0.58  1.0
  Os  Os2  1  0.38  0.0  0.49  1.0
  Rh  Rh3  1  0.0  0.0  0.08  1.0

data_Mn2OsRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.64
_cell_length_b   2.64
_cell_length_c   8.72
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   117.13
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2OsRh
_chemical_formula_sum   'Mn2 Os1 Rh1'
_cell_volume   54.0
_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  Mn0  1  0.0  0.0  0.58  1.0
  Mn  Mn1  1  0.38  0.0  0.65  1.0
  Os  Os2  1  0.38  0.0  0.49  1.0
  Rh  Rh3  1  0.0  0.0  0.08  1.0

Mn Mn Os Rh
Mn Mn Os Rh 0 1 o o o 0 2 o o o 1 2 o o o 3 3 + + o 3 3 o + o 3 3 + o o 