data_MnRh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05
_cell_length_b   5.05
_cell_length_c   5.05
_cell_angle_alpha   116.84
_cell_angle_beta   116.84
_cell_angle_gamma   116.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnRh3
_chemical_formula_sum   'Mn1 Rh3'
_cell_volume   58.04
_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  0.0  1.0
  Rh  Rh1  1  0.85  0.76  0.91  1.0
  Rh  Rh2  1  0.15  0.76  0.91  1.0
  Rh  Rh3  1  0.0  0.48  0.91  1.0

data_MnRh3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.72
_cell_length_b   5.05
_cell_length_c   5.05
_cell_angle_alpha   116.84
_cell_angle_beta   100.35
_cell_angle_gamma   100.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnRh3
_chemical_formula_sum   'Mn1 Rh3'
_cell_volume   58.04
_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  0.0  1.0
  Rh  Rh1  1  0.91  0.06  0.15  1.0
  Rh  Rh2  1  0.91  0.76  0.15  1.0
  Rh  Rh3  1  0.91  0.91  0.43  1.0

Mn Rh Rh Rh