# generated using pymatgen
data_Nb12V22GeIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.75285089
_cell_length_b   8.75284991
_cell_length_c   8.24781955
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999244
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb12V22GeIr
_chemical_formula_sum   'Nb12 V22 Ge1 Ir1'
_cell_volume   547.22865055
_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  0.33519795  1.00000000  0.06235010  1.0
  Nb  Nb1  1  0.66480205  0.00000000  0.93764990  1.0
  Nb  Nb2  1  1.00000000  0.33519795  0.06235010  1.0
  Nb  Nb3  1  0.66553172  0.00000000  0.55988577  1.0
  Nb  Nb4  1  1.00000000  0.33446828  0.44011423  1.0
  Nb  Nb5  1  0.00000000  0.66480205  0.93764990  1.0
  Nb  Nb6  1  0.33446828  1.00000000  0.44011423  1.0
  Nb  Nb7  1  0.00000000  0.66553172  0.55988577  1.0
  Nb  Nb8  1  0.66480205  0.66480205  0.06235010  1.0
  Nb  Nb9  1  0.33519795  0.33519795  0.93764990  1.0
  Nb  Nb10  1  0.33446828  0.33446828  0.55988577  1.0
  Nb  Nb11  1  0.66553172  0.66553172  0.44011423  1.0
  V  V12  1  0.16432695  0.49686011  0.74981235  1.0
  V  V13  1  0.83567305  0.50313989  0.25018765  1.0
  V  V14  1  0.50313989  0.66746684  0.74981235  1.0
  V  V15  1  0.49686011  0.16432695  0.74981235  1.0
  V  V16  1  0.49686011  0.33253316  0.25018765  1.0
  V  V17  1  0.50313989  0.83567305  0.25018765  1.0
  V  V18  1  0.33253316  0.83567305  0.74981235  1.0
  V  V19  1  0.66746684  0.50313989  0.74981235  1.0
  V  V20  1  0.66746684  0.16432695  0.25018765  1.0
  V  V21  1  0.33253316  0.49686011  0.25018765  1.0
  V  V22  1  0.83567305  0.33253316  0.74981235  1.0
  V  V23  1  0.16432695  0.66746684  0.25018765  1.0
  V  V24  1  0.33333300  0.66666700  0.50000000  1.0
  V  V25  1  0.66666700  0.33333300  0.50000000  1.0
  V  V26  1  0.66666700  0.33333300  0.00000000  1.0
  V  V27  1  0.33333300  0.66666700  0.00000000  1.0
  V  V28  1  0.17113195  0.00000000  0.75180118  1.0
  V  V29  1  0.82886805  1.00000000  0.24819882  1.0
  V  V30  1  0.00000000  0.17113195  0.75180118  1.0
  V  V31  1  1.00000000  0.82886805  0.24819882  1.0
  V  V32  1  0.82886805  0.82886805  0.75180118  1.0
  V  V33  1  0.17113195  0.17113195  0.24819882  1.0
  Ge  Ge34  1  0.00000000  0.00000000  0.50000000  1.0
  Ir  Ir35  1  0.00000000  0.00000000  0.00000000  1.0