data_[La8Ga4N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.7817]
_cell_length_b [3.8698]
_cell_length_c [8.9569]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.8658]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La4Ga2N]
_chemical_formula_sum '[La8 Ga4 N2]'
_cell_volume [367.8708]
_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  0.0835  0.0000  0.3319  1
  La  La1  4  0.1535  0.5000  0.0653  1
  Ga  Ga2  4  0.1173  0.5000  0.6558  1
  N  N3  2  0.0000  0.0000  0.0000  1
]