data_[Mn8V16Zn12N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  V  1.6300  1.3500  0.7775
  Zn  1.6500  1.3500  0.8800
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.6037]
_cell_length_b [4.9569]
_cell_length_c [13.2520]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.6475]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Mn2V4(ZnN)3]
_chemical_formula_sum '[Mn8 V16 Zn12 N12]'
_cell_volume [551.4489]
_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
[
  Mn  Mn0  8  0.0546  0.4157  0.9125  1
  V  V1  8  0.1102  0.0861  0.0824  1
  V  V2  8  0.2240  0.0835  0.4175  1
  Zn  Zn3  8  0.1647  0.4201  0.2499  1
  Zn  Zn4  4  0.0000  0.0848  0.7500  1
  N  N5  8  0.0826  0.2522  0.5000  1
  N  N6  4  0.2500  0.2500  0.0000  1
]