data_[Mn2Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [4.6290]
_cell_length_b [4.6290]
_cell_length_c [17.1444]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [MnRh2]
_chemical_formula_sum '[Mn2 Rh4]'
_cell_volume [318.1434]
_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  2  0.3333  0.6667  0.5632  1
  Rh  Rh1  3  0.0000  0.6618  0.4381  1
  Rh  Rh2  1  0.0000  0.0000  0.5593  1
]