# generated using pymatgen
data_Nb12Zn12CN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.16388060
_cell_length_b   8.16388159
_cell_length_c   8.16388120
_cell_angle_alpha   60.00000158
_cell_angle_beta   59.99999757
_cell_angle_gamma   60.00000469
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb12Zn12CN
_chemical_formula_sum   'Nb12 Zn12 C1 N1'
_cell_volume   384.74681355
_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
  Nb  Nb0  1  0.19152933  0.80847067  0.19152933  1.0
  Nb  Nb1  1  0.44065404  0.05934596  0.44065404  1.0
  Nb  Nb2  1  0.44065404  0.05934596  0.05934596  1.0
  Nb  Nb3  1  0.44065404  0.44065404  0.05934596  1.0
  Nb  Nb4  1  0.19152933  0.80847067  0.80847067  1.0
  Nb  Nb5  1  0.05934596  0.44065404  0.05934596  1.0
  Nb  Nb6  1  0.80847067  0.80847067  0.19152933  1.0
  Nb  Nb7  1  0.05934596  0.44065404  0.44065404  1.0
  Nb  Nb8  1  0.19152933  0.19152933  0.80847067  1.0
  Nb  Nb9  1  0.80847067  0.19152933  0.19152933  1.0
  Nb  Nb10  1  0.80847067  0.19152933  0.80847067  1.0
  Nb  Nb11  1  0.05934596  0.05934596  0.44065404  1.0
  Zn  Zn12  1  0.83268947  0.50193259  0.83268947  1.0
  Zn  Zn13  1  0.41765981  0.41765981  0.74701958  1.0
  Zn  Zn14  1  0.74701958  0.41765981  0.41765981  1.0
  Zn  Zn15  1  0.41765981  0.41765981  0.41765981  1.0
  Zn  Zn16  1  0.83268947  0.83268947  0.50193259  1.0
  Zn  Zn17  1  0.41765981  0.74701958  0.41765981  1.0
  Zn  Zn18  1  0.83268947  0.83268947  0.83268947  1.0
  Zn  Zn19  1  0.50193259  0.83268947  0.83268947  1.0
  Zn  Zn20  1  0.62513246  0.12460362  0.62513246  1.0
  Zn  Zn21  1  0.62513246  0.62513246  0.12460362  1.0
  Zn  Zn22  1  0.12460362  0.62513246  0.62513246  1.0
  Zn  Zn23  1  0.62513246  0.62513246  0.62513246  1.0
  C  C24  1  0.00000000  0.00000000  0.00000000  1.0
  N  N25  1  0.25000000  0.25000000  0.25000000  1.0