data_[Lu16Zr8Cd12N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  Zr  1.3300  1.5500  0.8600
  Cd  1.6900  1.5500  1.0900
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.0818]
_cell_length_b [5.8269]
_cell_length_c [15.6758]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.4106]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Lu4Zr2(CdN)3]
_chemical_formula_sum '[Lu16 Zr8 Cd12 N12]'
_cell_volume [899.3648]
_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
[
  Lu  Lu0  8  0.1122  0.0807  0.5863  1
  Lu  Lu1  8  0.2196  0.0855  0.9136  1
  Zr  Zr2  8  0.0588  0.4156  0.4233  1
  Cd  Cd3  8  0.1522  0.4336  0.7496  1
  Cd  Cd4  4  0.0000  0.1104  0.2500  1
  N  N5  8  0.0834  0.2500  1.0000  1
  N  N6  4  0.2500  0.2500  0.5000  1
]