data_[Ca4Mg6Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Mg  1.3100  1.5000  0.8600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.4435]
_cell_length_b [4.2624]
_cell_length_c [7.5538]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5668]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ca2Mg3Rh2]
_chemical_formula_sum '[Ca4 Mg6 Rh4]'
_cell_volume [308.2075]
_cell_formula_units_Z [2]
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  4  0.1451  0.0000  0.7928  1.0
  Mg  Mg1  4  0.1418  0.5000  0.4357  1.0
  Mg  Mg2  2  0.0000  0.5000  0.0000  1.0
  Rh  Rh3  4  0.1417  0.0000  0.2031  1.0
]