# generated using pymatgen
data_Nb6CuAu3N2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.10198301
_cell_length_b   7.08051413
_cell_length_c   7.08866547
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.96213834
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6CuAu3N2
_chemical_formula_sum   'Nb12 Cu2 Au6 N4'
_cell_volume   356.45836412
_cell_formula_units_Z   2
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  0.79409515  0.95753039  0.37483768  1.0
  Nb  Nb1  1  0.70590485  0.04246961  0.87483768  1.0
  Nb  Nb2  1  0.20657386  0.46194823  0.12968946  1.0
  Nb  Nb3  1  0.29342614  0.53805177  0.62968946  1.0
  Nb  Nb4  1  0.96064424  0.37118576  0.79276462  1.0
  Nb  Nb5  1  0.04154619  0.87671963  0.70593505  1.0
  Nb  Nb6  1  0.45845381  0.12328037  0.20593505  1.0
  Nb  Nb7  1  0.53935576  0.62881424  0.29276462  1.0
  Nb  Nb8  1  0.37218371  0.79427255  0.95984594  1.0
  Nb  Nb9  1  0.87674623  0.70859061  0.04150542  1.0
  Nb  Nb10  1  0.12781629  0.20572745  0.45984594  1.0
  Nb  Nb11  1  0.62325377  0.29140939  0.54150542  1.0
  Cu  Cu12  1  0.18685940  0.81998401  0.31487180  1.0
  Cu  Cu13  1  0.31314060  0.18001599  0.81487180  1.0
  Au  Au14  1  0.81716667  0.31679892  0.18405967  1.0
  Au  Au15  1  0.68283333  0.68320108  0.68405967  1.0
  Au  Au16  1  0.55389611  0.42252085  0.93006288  1.0
  Au  Au17  1  0.42110650  0.93699582  0.56665097  1.0
  Au  Au18  1  0.94610389  0.57747915  0.43006288  1.0
  Au  Au19  1  0.07889350  0.06300418  0.06665097  1.0
  N  N20  1  0.87363266  0.12494006  0.62382007  1.0
  N  N21  1  0.62636734  0.87505994  0.12382007  1.0
  N  N22  1  0.12307253  0.62419563  0.87595744  1.0
  N  N23  1  0.37692747  0.37580437  0.37595744  1.0