# generated using pymatgen data_Ta3Co2SiN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.92565395 _cell_length_b 7.92565017 _cell_length_c 7.92565498 _cell_angle_alpha 59.99971329 _cell_angle_beta 59.99972081 _cell_angle_gamma 59.99985267 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Co2SiN _chemical_formula_sum 'Ta12 Co8 Si4 N4' _cell_volume 352.03660932 _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 Ta Ta0 1 0.80019993 0.80020321 0.19980257 1.0 Ta Ta1 1 0.19978040 0.19979357 0.80019743 1.0 Ta Ta2 1 0.80021095 0.19980058 0.80020198 1.0 Ta Ta3 1 0.19979259 0.80019622 0.19979196 1.0 Ta Ta4 1 0.19980225 0.80020959 0.80019616 1.0 Ta Ta5 1 0.80019589 0.19979483 0.19978771 1.0 Ta Ta6 1 0.44979024 0.44978932 0.05020046 1.0 Ta Ta7 1 0.05021771 0.05021152 0.44980237 1.0 Ta Ta8 1 0.44978342 0.05020257 0.44979172 1.0 Ta Ta9 1 0.05021482 0.44979845 0.05021375 1.0 Ta Ta10 1 0.05020017 0.44978617 0.44979472 1.0 Ta Ta11 1 0.44980382 0.05021520 0.05021431 1.0 Co Co12 1 0.74185454 0.41936866 0.41937940 1.0 Co Co13 1 0.41938160 0.74184729 0.41937630 1.0 Co Co14 1 0.41937916 0.41936828 0.74185494 1.0 Co Co15 1 0.41939063 0.41937390 0.41938638 1.0 Co Co16 1 0.50812867 0.83063486 0.83062824 1.0 Co Co17 1 0.83062476 0.50814026 0.83062868 1.0 Co Co18 1 0.83062514 0.83063595 0.50813147 1.0 Co Co19 1 0.83061925 0.83062908 0.83062119 1.0 Si Si20 1 0.12499795 0.62500142 0.62500095 1.0 Si Si21 1 0.62500247 0.12499849 0.62500016 1.0 Si Si22 1 0.62500237 0.62500066 0.12499794 1.0 Si Si23 1 0.62500180 0.62500002 0.62499975 1.0 N N24 1 0.62500000 0.12499971 0.12499939 1.0 N N25 1 0.12499941 0.62499881 0.12500026 1.0 N N26 1 0.12499937 0.12500033 0.62499836 1.0 N N27 1 0.12500071 0.12500104 0.12500145 1.0