data_CaPtRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.85
_cell_length_b   4.7
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   99.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPtRh2
_chemical_formula_sum   'Ca1 Pt1 Rh2'
_cell_volume   68.72
_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
  Pt  Pt1  1  0.02  0.0  0.56  1.0
  Rh  Rh2  1  0.34  0.35  0.7  1.0
  Rh  Rh3  1  0.7  0.35  0.43  1.0

data_CaPtRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.85
_cell_length_b   4.7
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   99.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaPtRh2
_chemical_formula_sum   'Ca1 Pt1 Rh2'
_cell_volume   68.72
_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
  Pt  Pt1  1  0.02  0.0  0.56  1.0
  Rh  Rh2  1  0.34  0.35  0.7  1.0
  Rh  Rh3  1  0.7  0.35  0.43  1.0

Ca Pt Rh Rh