# generated using pymatgen data_Zr8IrPt3N2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.83702436 _cell_length_b 8.83702434 _cell_length_c 8.83211008 _cell_angle_alpha 60.01839761 _cell_angle_beta 60.01839766 _cell_angle_gamma 60.04223573 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8IrPt3N2 _chemical_formula_sum 'Zr16 Ir2 Pt6 N4' _cell_volume 488.00110096 _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 Zr Zr0 1 0.11588264 0.62978552 0.62716542 1.0 Zr Zr1 1 0.62978552 0.11588264 0.62716542 1.0 Zr Zr2 1 0.62756470 0.62756470 0.12043480 1.0 Zr Zr3 1 0.62756470 0.62756470 0.62443580 1.0 Zr Zr4 1 0.81763175 0.81763175 0.18236825 1.0 Zr Zr5 1 0.18200930 0.18200930 0.81799070 1.0 Zr Zr6 1 0.81769553 0.17888318 0.81801776 1.0 Zr Zr7 1 0.17888318 0.81769553 0.18540253 1.0 Zr Zr8 1 0.17888318 0.81769553 0.81801776 1.0 Zr Zr9 1 0.81769553 0.17888318 0.18540253 1.0 Zr Zr10 1 0.43270215 0.43270215 0.06729785 1.0 Zr Zr11 1 0.06696964 0.06696964 0.43303036 1.0 Zr Zr12 1 0.43313299 0.06757609 0.43240523 1.0 Zr Zr13 1 0.06757609 0.43313299 0.06688569 1.0 Zr Zr14 1 0.06757609 0.43313299 0.43240523 1.0 Zr Zr15 1 0.43313299 0.06757609 0.06688569 1.0 Ir Ir16 1 0.84605042 0.84605042 0.46242940 1.0 Ir Ir17 1 0.84605042 0.84605042 0.84546977 1.0 Pt Pt18 1 0.77906093 0.40637792 0.40728058 1.0 Pt Pt19 1 0.40637792 0.77906093 0.40728058 1.0 Pt Pt20 1 0.40750756 0.40750756 0.77670869 1.0 Pt Pt21 1 0.40750756 0.40750756 0.40827619 1.0 Pt Pt22 1 0.46687087 0.84405826 0.84453493 1.0 Pt Pt23 1 0.84405826 0.46687087 0.84453493 1.0 N N24 1 0.62408347 0.12621259 0.12485197 1.0 N N25 1 0.12621259 0.62408347 0.12485197 1.0 N N26 1 0.12576602 0.12576602 0.62395270 1.0 N N27 1 0.12576602 0.12576602 0.12451527 1.0