data_CaCoRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87
_cell_length_b   4.87
_cell_length_c   4.87
_cell_angle_alpha   131.99
_cell_angle_beta   131.99
_cell_angle_gamma   70.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCoRh2
_chemical_formula_sum   'Ca1 Co1 Rh2'
_cell_volume   62.56
_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
  Ca  Ca0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.98  0.0  0.99  1.0
  Rh  Rh2  1  0.0  0.0  0.98  1.0
  Rh  Rh3  1  0.0  0.98  0.99  1.0

data_CaCoRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.96
_cell_length_b   3.96
_cell_length_c   4.87
_cell_angle_alpha   114.01
_cell_angle_beta   114.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCoRh2
_chemical_formula_sum   'Ca1 Co1 Rh2'
_cell_volume   62.56
_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
  Ca  Ca0  1  0.0  0.0  0.0  1.0
  Co  Co1  1  0.99  0.01  0.01  1.0
  Rh  Rh2  1  0.01  0.99  0.01  1.0
  Rh  Rh3  1  0.98  0.98  0.98  1.0

Ca Co Rh Rh