data_MnCo2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.56
_cell_length_b   2.56
_cell_length_c   6.89
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   92.27
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnCo2Rh
_chemical_formula_sum   'Mn1 Co2 Rh1'
_cell_volume   45.03
_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  Mn2  1  0.0  0.0  0.0  1.0
  Co  Co0  1  0.77  0.0  0.3  1.0
  Co  Co1  1  0.77  0.0  0.59  1.0
  Rh  Rh3  1  0.0  0.0  0.44  1.0

data_MnCo2Rh
_symmetry_space_group_name_H-M   Pm
_cell_length_a   2.56
_cell_length_b   2.56
_cell_length_c   6.89
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   MnCo2Rh
_chemical_formula_sum   'Mn1 Co2 Rh1'
_cell_volume   45.07
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Co  Co1  1  0.77  0.0  0.3  1.0
  Co  Co2  1  0.77  0.0  0.59  1.0
  Rh  Rh3  1  0.0  0.0  0.44  1.0

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