data_[Sr16Tc6N16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tc  1.9000  1.3500  0.7417
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.2646]
_cell_length_b [5.3794]
_cell_length_c [7.6976]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2120]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr8Tc3N8]
_chemical_formula_sum '[Sr16 Tc6 N16]'
_cell_volume [765.9995]
_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
[
  Sr  Sr0  4  0.0258  0.0000  0.2630  1
  Sr  Sr1  4  0.0991  0.5000  0.9506  1
  Sr  Sr2  4  0.1646  0.5000  0.4678  1
  Sr  Sr3  4  0.1988  0.0000  0.7970  1
  Tc  Tc4  4  0.1867  0.0000  0.2033  1
  Tc  Tc5  2  0.0000  0.5000  0.5000  1
  N  N6  4  0.0256  0.5000  0.2836  1
  N  N7  4  0.1032  0.0000  0.0034  1
  N  N8  4  0.1769  0.0000  0.4352  1
  N  N9  4  0.2205  0.5000  0.8293  1
]