# generated using pymatgen data_Zr12Zn9Pd3N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.54919624 _cell_length_b 8.54919625 _cell_length_c 8.54919687 _cell_angle_alpha 60.11233014 _cell_angle_beta 60.11233009 _cell_angle_gamma 60.11232670 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr12Zn9Pd3N4 _chemical_formula_sum 'Zr12 Zn9 Pd3 N4' _cell_volume 442.96025003 _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 Zr Zr0 1 0.81198330 0.18803243 0.18803243 1.0 Zr Zr1 1 0.18803243 0.81198330 0.18803243 1.0 Zr Zr2 1 0.81216636 0.81216636 0.18582621 1.0 Zr Zr3 1 0.18582621 0.81216636 0.81216636 1.0 Zr Zr4 1 0.81216636 0.18582621 0.81216636 1.0 Zr Zr5 1 0.18803243 0.18803243 0.81198330 1.0 Zr Zr6 1 0.43801670 0.06196757 0.06196757 1.0 Zr Zr7 1 0.06196757 0.43801670 0.06196757 1.0 Zr Zr8 1 0.43783364 0.43783364 0.06417379 1.0 Zr Zr9 1 0.06417379 0.43783364 0.43783364 1.0 Zr Zr10 1 0.43783364 0.06417379 0.43783364 1.0 Zr Zr11 1 0.06196757 0.06196757 0.43801670 1.0 Zn Zn12 1 0.41943833 0.41943833 0.74345606 1.0 Zn Zn13 1 0.41965070 0.41965070 0.41965070 1.0 Zn Zn14 1 0.74345606 0.41943833 0.41943833 1.0 Zn Zn15 1 0.41943833 0.74345606 0.41943833 1.0 Zn Zn16 1 0.83056167 0.83056167 0.50654394 1.0 Zn Zn17 1 0.83034930 0.83034930 0.83034930 1.0 Zn Zn18 1 0.50654394 0.83056167 0.83056167 1.0 Zn Zn19 1 0.83056167 0.50654394 0.83056167 1.0 Zn Zn20 1 0.62500000 0.62500000 0.62500000 1.0 Pd Pd21 1 0.62500000 0.62500000 0.12500000 1.0 Pd Pd22 1 0.12500000 0.62500000 0.62500000 1.0 Pd Pd23 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