data_[Ca1In2Rh1N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  In  1.7800  1.5500  0.9400
  Rh  2.2800  1.3500  0.7450
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [3.2973]
_cell_length_b [3.2973]
_cell_length_c [9.2926]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [CaIn2RhN2]
_chemical_formula_sum '[Ca1 In2 Rh1 N2]'
_cell_volume [101.0325]
_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  0.0000  0.0000  0.6135  1
  In  In1  1  0.0000  0.0000  0.1329  1
  In  In2  1  0.5000  0.5000  0.8705  1
  Rh  Rh3  1  0.5000  0.5000  0.3963  1
  N  N4  1  0.0000  0.0000  0.3654  1
  N  N5  1  0.5000  0.5000  0.6215  1
]