data_[La6Dy2Zr4N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Dy  1.2200  1.7500  1.1310
  Zr  1.3300  1.5500  0.8600
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.0153]
_cell_length_b [10.4145]
_cell_length_c [6.2079]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7967]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3DyZr2N6]
_chemical_formula_sum '[La6 Dy2 Zr4 N12]'
_cell_volume [368.1639]
_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
[
  La  La0  4  0.0000  0.1662  0.5000  1
  La  La1  2  0.0000  0.5000  0.5000  1
  Dy  Dy2  2  0.0000  0.0000  0.0000  1
  Zr  Zr3  4  0.0000  0.3337  0.0000  1
  N  N4  8  0.2458  0.1734  0.2168  1
  N  N5  4  0.2240  0.5000  0.2139  1
]