data_CrRh5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   4.38
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrRh5
_chemical_formula_sum   'Cr1 Rh5'
_cell_volume   95.22
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.25  0.17  0.19  1.0
  Rh  Rh2  1  0.5  0.45  0.0  1.0
  Rh  Rh3  1  0.75  0.17  0.19  1.0
  Rh  Rh4  1  0.5  0.0  0.19  1.0
  Rh  Rh5  1  0.0  0.89  0.0  1.0

data_CrRh5
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.38
_cell_length_b   5.01
_cell_length_c   5.01
_cell_angle_alpha   120.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrRh5
_chemical_formula_sum   'Cr1 Rh5'
_cell_volume   95.22
_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
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.0  0.0  0.89  1.0
  Rh  Rh2  1  0.0  0.5  0.45  1.0
  Rh  Rh3  1  0.19  0.25  0.17  1.0
  Rh  Rh4  1  0.19  0.5  0.0  1.0
  Rh  Rh5  1  0.19  0.75  0.17  1.0

Cr Rh Rh Rh Rh Rh
Cr Rh Rh Rh Rh Rh 0 5 o - o 0 1 o o o 1 5 o - o 1 2 o o o 3 4 o o o 