data_[Mn8Ge2C3N3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Ge  2.0100  1.2500  0.7700
  C  2.5500  0.7000  0.3000
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [2.9024]
_cell_length_b [2.9024]
_cell_length_c [21.4404]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Mn8Ge2(CN)3]
_chemical_formula_sum '[Mn8 Ge2 C3 N3]'
_cell_volume [156.4180]
_cell_formula_units_Z [1]
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  2  0.0000  0.0000  0.1555  1
  Mn  Mn1  2  0.0000  0.0000  0.3412  1
  Mn  Mn2  2  0.3333  0.6667  0.0544  1
  Mn  Mn3  2  0.3333  0.6667  0.4438  1
  Ge  Ge4  2  0.3333  0.6667  0.2487  1
  C  C5  2  0.3333  0.6667  0.8879  1
  C  C6  1  0.0000  0.0000  0.0000  1
  N  N7  2  0.3333  0.6667  0.6124  1
  N  N8  1  0.0000  0.0000  0.5000  1
]