# generated using pymatgen
data_Ni6B6Ir6Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.29582079
_cell_length_b   6.29582151
_cell_length_c   6.29582023
_cell_angle_alpha   103.59002839
_cell_angle_beta   103.59002660
_cell_angle_gamma   103.59003602
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni6B6Ir6Pb
_chemical_formula_sum   'Ni6 B6 Ir6 Pb1'
_cell_volume   224.37507532
_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
  Ni  Ni0  1  0.79919839  0.54217062  0.54217062  1.0
  Ni  Ni1  1  0.54217062  0.54217062  0.79919839  1.0
  Ni  Ni2  1  0.54217062  0.79919839  0.54217062  1.0
  Ni  Ni3  1  0.20080161  0.45782938  0.45782938  1.0
  Ni  Ni4  1  0.45782938  0.45782938  0.20080161  1.0
  Ni  Ni5  1  0.45782938  0.20080161  0.45782938  1.0
  B  B6  1  0.34711044  0.76786791  0.76786791  1.0
  B  B7  1  0.76786791  0.76786791  0.34711044  1.0
  B  B8  1  0.76786791  0.34711044  0.76786791  1.0
  B  B9  1  0.65288956  0.23213209  0.23213209  1.0
  B  B10  1  0.23213209  0.23213209  0.65288956  1.0
  B  B11  1  0.23213209  0.65288956  0.23213209  1.0
  Ir  Ir12  1  0.86124963  0.13875037  0.50000000  1.0
  Ir  Ir13  1  0.13875037  0.50000000  0.86124963  1.0
  Ir  Ir14  1  0.50000000  0.86124963  0.13875037  1.0
  Ir  Ir15  1  0.86124963  0.50000000  0.13875037  1.0
  Ir  Ir16  1  0.50000000  0.13875037  0.86124963  1.0
  Ir  Ir17  1  0.13875037  0.86124963  0.50000000  1.0
  Pb  Pb18  1  0.00000000  0.00000000  0.00000000  1.0