data_[Ba4Zn2Mo2N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Zn  1.6500  1.3500  0.8800
  Mo  2.1600  1.4500  0.7750
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [6.0596]
_cell_length_b [7.2150]
_cell_length_c [6.5909]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Ba2ZnMoN4]
_chemical_formula_sum '[Ba4 Zn2 Mo2 N8]'
_cell_volume [288.1497]
_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
[
  Ba  Ba0  4  0.0000  0.2513  0.7548  1.0
  Zn  Zn1  2  0.0000  0.0000  0.3054  1.0
  Mo  Mo2  2  0.0000  0.5000  0.3158  1.0
  N  N3  4  0.0000  0.2719  0.1677  1.0
  N  N4  4  0.2450  0.5000  0.4866  1.0
]