data_[Sm12Rh4I6N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Rh  2.2800  1.3500  0.7450
  I  2.6600  1.4000  1.2733
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0036]
_cell_length_b [12.0980]
_cell_length_c [8.2734]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.0556]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm6Rh2I3N]
_chemical_formula_sum '[Sm12 Rh4 I6 N2]'
_cell_volume [673.6577]
_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
[
  Sm  Sm0  8  0.2127  0.1554  0.1749  1
  Sm  Sm1  4  0.2452  0.5000  0.1764  1
  Rh  Rh2  4  0.0000  0.3332  0.0000  1
  I  I3  4  0.0000  0.1666  0.5000  1
  I  I4  2  0.0000  0.5000  0.5000  1
  N  N5  2  0.0000  0.0000  0.0000  1
]