data_[La18Pt3Rh6N3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pt  2.2800  1.3500  0.8050
  Rh  2.2800  1.3500  0.7450
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [7.0750]
_cell_length_b [7.0750]
_cell_length_c [19.7122]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [La6PtRh2N]
_chemical_formula_sum '[La18 Pt3 Rh6 N3]'
_cell_volume [854.5133]
_cell_formula_units_Z [3]
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
[
  La  La0  9  0.0017  0.7006  0.5879  1.0
  La  La1  9  0.0123  0.3117  0.7473  1.0
  Pt  Pt2  3  0.0000  0.0000  0.1733  1.0
  Rh  Rh3  3  0.0000  0.0000  0.4866  1.0
  Rh  Rh4  3  0.0000  0.0000  0.9998  1.0
  N  N5  3  0.0000  0.0000  0.6750  1.0
]