# generated using pymatgen data_Ta12Mn3Ga9N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.20721873 _cell_length_b 8.20375030 _cell_length_c 8.20375050 _cell_angle_alpha 60.00861395 _cell_angle_beta 60.02262665 _cell_angle_gamma 60.02262781 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta12Mn3Ga9N4 _chemical_formula_sum 'Ta12 Mn3 Ga9 N4' _cell_volume 390.73527439 _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 Ta Ta0 1 0.81126525 0.80817376 0.19029158 1.0 Ta Ta1 1 0.19076651 0.19561468 0.80680820 1.0 Ta Ta2 1 0.81126525 0.19029158 0.80817376 1.0 Ta Ta3 1 0.19076651 0.80680820 0.19561468 1.0 Ta Ta4 1 0.19078543 0.80680776 0.80680776 1.0 Ta Ta5 1 0.81126295 0.19028091 0.19028091 1.0 Ta Ta6 1 0.43873475 0.44182624 0.05970842 1.0 Ta Ta7 1 0.05923349 0.05438532 0.44319180 1.0 Ta Ta8 1 0.43873475 0.05970842 0.44182624 1.0 Ta Ta9 1 0.05923349 0.44319180 0.05438532 1.0 Ta Ta10 1 0.05921457 0.44319224 0.44319224 1.0 Ta Ta11 1 0.43873705 0.05971909 0.05971909 1.0 Mn Mn12 1 0.62500000 0.12500000 0.62500000 1.0 Mn Mn13 1 0.62500000 0.62500000 0.12500000 1.0 Mn Mn14 1 0.62500000 0.62500000 0.62500000 1.0 Ga Ga15 1 0.12500000 0.62500000 0.62500000 1.0 Ga Ga16 1 0.76649530 0.41108697 0.41108697 1.0 Ga Ga17 1 0.42048379 0.76099612 0.40915778 1.0 Ga Ga18 1 0.42048379 0.40915778 0.76099612 1.0 Ga Ga19 1 0.42057535 0.40924580 0.40924580 1.0 Ga Ga20 1 0.48350470 0.83891303 0.83891303 1.0 Ga Ga21 1 0.82951621 0.48900388 0.84084222 1.0 Ga Ga22 1 0.82951621 0.84084222 0.48900388 1.0 Ga Ga23 1 0.82942465 0.84075420 0.84075420 1.0 N N24 1 0.62500000 0.12500000 0.12500000 1.0 N N25 1 0.12500000 0.62500000 0.12500000 1.0 N N26 1 0.12500000 0.12500000 0.62500000 1.0 N N27 1 0.12500000 0.12500000 0.12500000 1.0