data_[Y8Lu16Sn12N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Lu  1.2700  1.7500  1.0010
  Sn  1.9600  1.4500  0.8300
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.4269]
_cell_length_b [6.0205]
_cell_length_c [15.4486]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.0398]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y2Lu4(SnN)3]
_chemical_formula_sum '[Y8 Lu16 Sn12 N12]'
_cell_volume [944.7794]
_cell_formula_units_Z [4]
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
[
  Y  Y0  8  0.0517  0.4177  0.9094  1
  Lu  Lu1  8  0.1110  0.0860  0.0829  1
  Lu  Lu2  8  0.2236  0.0820  0.4172  1
  Sn  Sn3  8  0.1782  0.5945  0.7506  1
  Sn  Sn4  4  0.0000  0.0606  0.7500  1
  N  N5  8  0.0860  0.2422  0.5000  1
  N  N6  4  0.2500  0.2500  0.0000  1
]