data_[Yb14Ga6N4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Yb  1.1000  1.7500  1.0840
  Ga  1.8100  1.3000  0.7600
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [4.7928]
_cell_length_b [23.8351]
_cell_length_c [4.7455]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Yb7Ga3N2]
_chemical_formula_sum '[Yb14 Ga6 N4]'
_cell_volume [542.1134]
_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
[
  Yb  Yb0  4  0.0000  0.0990  0.5000  1.0
  Yb  Yb1  4  0.0000  0.1997  0.0000  1.0
  Yb  Yb2  4  0.0000  0.3993  0.0000  1.0
  Yb  Yb3  2  0.0000  0.0000  0.0000  1.0
  Ga  Ga4  4  0.0000  0.2895  0.5000  1.0
  Ga  Ga5  2  0.0000  0.5000  0.5000  1.0
  N  N6  4  0.0000  0.1053  0.0000  1.0
]