# generated using pymatgen
data_Nb3Zn2AuC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.40010049
_cell_length_b   8.40010090
_cell_length_c   8.40010009
_cell_angle_alpha   59.99999546
_cell_angle_beta   59.99999384
_cell_angle_gamma   59.99999079
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3Zn2AuC
_chemical_formula_sum   'Nb12 Zn8 Au4 C4'
_cell_volume   419.11999643
_cell_formula_units_Z   4
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  0.81988298  0.18011702  0.81988298  1.0
  Nb  Nb1  1  0.06988298  0.43011702  0.43011702  1.0
  Nb  Nb2  1  0.43011702  0.06988298  0.06988298  1.0
  Nb  Nb3  1  0.06988298  0.43011702  0.06988298  1.0
  Nb  Nb4  1  0.43011702  0.43011702  0.06988298  1.0
  Nb  Nb5  1  0.06988298  0.06988298  0.43011702  1.0
  Nb  Nb6  1  0.81988298  0.81988298  0.18011702  1.0
  Nb  Nb7  1  0.18011702  0.81988298  0.81988298  1.0
  Nb  Nb8  1  0.81988298  0.18011702  0.18011702  1.0
  Nb  Nb9  1  0.18011702  0.18011702  0.81988298  1.0
  Nb  Nb10  1  0.43011702  0.06988298  0.43011702  1.0
  Nb  Nb11  1  0.18011702  0.81988298  0.18011702  1.0
  Zn  Zn12  1  0.41493414  0.41493414  0.41493414  1.0
  Zn  Zn13  1  0.49480241  0.83506586  0.83506586  1.0
  Zn  Zn14  1  0.83506586  0.49480241  0.83506586  1.0
  Zn  Zn15  1  0.83506586  0.83506586  0.49480241  1.0
  Zn  Zn16  1  0.41493414  0.75519759  0.41493414  1.0
  Zn  Zn17  1  0.41493414  0.41493414  0.75519759  1.0
  Zn  Zn18  1  0.75519759  0.41493414  0.41493414  1.0
  Zn  Zn19  1  0.83506586  0.83506586  0.83506586  1.0
  Au  Au20  1  0.62500000  0.62500000  0.62500000  1.0
  Au  Au21  1  0.12500000  0.62500000  0.62500000  1.0
  Au  Au22  1  0.62500000  0.12500000  0.62500000  1.0
  Au  Au23  1  0.62500000  0.62500000  0.12500000  1.0
  C  C24  1  0.12500000  0.12500000  0.12500000  1.0
  C  C25  1  0.62500000  0.12500000  0.12500000  1.0
  C  C26  1  0.12500000  0.62500000  0.12500000  1.0
  C  C27  1  0.12500000  0.12500000  0.62500000  1.0