# generated using pymatgen data_Zr3Zn2AuN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.61037163 _cell_length_b 8.61037265 _cell_length_c 8.61037328 _cell_angle_alpha 60.00000508 _cell_angle_beta 60.00000116 _cell_angle_gamma 59.99999820 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Zn2AuN _chemical_formula_sum 'Zr12 Zn8 Au4 N4' _cell_volume 451.38886326 _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 Zr Zr0 1 0.81279566 0.18720434 0.18720434 1.0 Zr Zr1 1 0.18720434 0.81279566 0.18720434 1.0 Zr Zr2 1 0.81279566 0.81279566 0.18720434 1.0 Zr Zr3 1 0.18720434 0.81279566 0.81279566 1.0 Zr Zr4 1 0.81279566 0.18720434 0.81279566 1.0 Zr Zr5 1 0.18720434 0.18720434 0.81279566 1.0 Zr Zr6 1 0.43720434 0.06279566 0.06279566 1.0 Zr Zr7 1 0.06279566 0.43720434 0.06279566 1.0 Zr Zr8 1 0.43720434 0.43720434 0.06279566 1.0 Zr Zr9 1 0.06279566 0.43720434 0.43720434 1.0 Zr Zr10 1 0.43720434 0.06279566 0.43720434 1.0 Zr Zr11 1 0.06279566 0.06279566 0.43720434 1.0 Zn Zn12 1 0.41685817 0.41685817 0.74942448 1.0 Zn Zn13 1 0.41685817 0.41685817 0.41685817 1.0 Zn Zn14 1 0.74942448 0.41685817 0.41685817 1.0 Zn Zn15 1 0.41685817 0.74942448 0.41685817 1.0 Zn Zn16 1 0.83314183 0.83314183 0.50057552 1.0 Zn Zn17 1 0.83314183 0.83314183 0.83314183 1.0 Zn Zn18 1 0.50057552 0.83314183 0.83314183 1.0 Zn Zn19 1 0.83314183 0.50057552 0.83314183 1.0 Au Au20 1 0.62500000 0.62500000 0.12500000 1.0 Au Au21 1 0.62500000 0.62500000 0.62500000 1.0 Au Au22 1 0.12500000 0.62500000 0.62500000 1.0 Au Au23 1 0.62500000 0.12500000 0.62500000 1.0 N N24 1 0.12500000 0.12500000 0.62500000 1.0 N N25 1 0.12500000 0.12500000 0.12500000 1.0 N N26 1 0.62500000 0.12500000 0.12500000 1.0 N N27 1 0.12500000 0.62500000 0.12500000 1.0