# generated using pymatgen data_Zr3Zn2PdC _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62748352 _cell_length_b 8.62748379 _cell_length_c 8.62748449 _cell_angle_alpha 59.99999732 _cell_angle_beta 59.99999626 _cell_angle_gamma 59.99999856 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Zn2PdC _chemical_formula_sum 'Zr12 Zn8 Pd4 C4' _cell_volume 454.08531200 _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 0.44038810 0.44038810 0.05961190 1.0 Zr Zr1 1 0.05961190 0.44038810 0.05961190 1.0 Zr Zr2 1 0.44038810 0.05961190 0.05961190 1.0 Zr Zr3 1 0.05961190 0.05961190 0.44038810 1.0 Zr Zr4 1 0.44038810 0.05961190 0.44038810 1.0 Zr Zr5 1 0.05961190 0.44038810 0.44038810 1.0 Zr Zr6 1 0.80961190 0.80961190 0.19038810 1.0 Zr Zr7 1 0.19038810 0.80961190 0.19038810 1.0 Zr Zr8 1 0.80961190 0.19038810 0.19038810 1.0 Zr Zr9 1 0.19038810 0.19038810 0.80961190 1.0 Zr Zr10 1 0.80961190 0.19038810 0.80961190 1.0 Zr Zr11 1 0.19038810 0.80961190 0.80961190 1.0 Zn Zn12 1 0.83149552 0.83149552 0.50551343 1.0 Zn Zn13 1 0.83149552 0.50551343 0.83149552 1.0 Zn Zn14 1 0.50551343 0.83149552 0.83149552 1.0 Zn Zn15 1 0.83149552 0.83149552 0.83149552 1.0 Zn Zn16 1 0.41850448 0.41850448 0.74448657 1.0 Zn Zn17 1 0.41850448 0.74448657 0.41850448 1.0 Zn Zn18 1 0.74448657 0.41850448 0.41850448 1.0 Zn Zn19 1 0.41850448 0.41850448 0.41850448 1.0 Pd Pd20 1 0.62500000 0.62500000 0.12500000 1.0 Pd Pd21 1 0.62500000 0.12500000 0.62500000 1.0 Pd Pd22 1 0.12500000 0.62500000 0.62500000 1.0 Pd Pd23 1 0.62500000 0.62500000 0.62500000 1.0 C C24 1 0.12500000 0.12500000 0.62500000 1.0 C C25 1 0.12500000 0.62500000 0.12500000 1.0 C C26 1 0.62500000 0.12500000 0.12500000 1.0 C C27 1 0.12500000 0.12500000 0.12500000 1.0