data_[Sr4W4N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  W  2.3600  1.3500  0.7667
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [12.9069]
_cell_length_b [3.8070]
_cell_length_c [6.9546]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.3979]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [SrWN3]
_chemical_formula_sum '[Sr4 W4 N12]'
_cell_volume [308.6966]
_cell_formula_units_Z [4]
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
[
  Sr  Sr0  2  0.0109  0.5000  0.7460  1.0
  Sr  Sr1  2  0.2917  0.0000  0.2214  1.0
  W  W2  2  0.0222  0.0000  0.2243  1.0
  W  W3  2  0.2269  0.5000  0.5759  1.0
  N  N4  2  0.0363  0.5000  0.3531  1.0
  N  N5  2  0.0721  0.0000  0.0186  1.0
  N  N6  2  0.1820  0.0000  0.4954  1.0
  N  N7  2  0.2669  0.5000  0.8704  1.0
  N  N8  2  0.3546  0.5000  0.5252  1.0
  N  N9  2  0.3611  0.5000  0.0539  1.0
]