data_[La2Pr2Y2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Y  1.2200  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.2287]
_cell_length_b [3.6360]
_cell_length_c [9.3466]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.7391]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LaPrYN3]
_chemical_formula_sum '[La2 Pr2 Y2 N6]'
_cell_volume [207.2520]
_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  2  0.3544  0.7500  0.3058  1
  Pr  Pr1  2  0.2298  0.2500  0.9536  1
  Y  Y2  2  0.1435  0.7500  0.6379  1
  N  N3  2  0.0315  0.2500  0.1579  1
  N  N4  2  0.2411  0.2500  0.5147  1
  N  N5  2  0.4624  0.7500  0.8199  1
]