# generated using pymatgen data_Ta12Ga5Ni7N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.05447065 _cell_length_b 8.06260724 _cell_length_c 8.06260577 _cell_angle_alpha 59.99999806 _cell_angle_beta 59.96657544 _cell_angle_gamma 59.96657466 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta12Ga5Ni7N4 _chemical_formula_sum 'Ta12 Ga5 Ni7 N4' _cell_volume 370.04396863 _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 0.30757624 0.69115483 0.69115483 1.0 Ta Ta1 1 0.56204600 0.55358879 0.94218210 1.0 Ta Ta2 1 0.30757624 0.69115483 0.31011610 1.0 Ta Ta3 1 0.30757624 0.31011610 0.69115483 1.0 Ta Ta4 1 0.68826518 0.31515330 0.31515330 1.0 Ta Ta5 1 0.93330289 0.93632628 0.56518591 1.0 Ta Ta6 1 0.93330289 0.56518591 0.93632628 1.0 Ta Ta7 1 0.93330289 0.56518591 0.56518591 1.0 Ta Ta8 1 0.56204600 0.94218210 0.94218210 1.0 Ta Ta9 1 0.68826518 0.68142922 0.31515330 1.0 Ta Ta10 1 0.68826518 0.31515330 0.68142922 1.0 Ta Ta11 1 0.56204600 0.94218210 0.55358879 1.0 Ga Ga12 1 0.02289032 0.32570356 0.32570356 1.0 Ga Ga13 1 0.12796353 0.11705516 0.63792614 1.0 Ga Ga14 1 0.12796353 0.11705516 0.11705516 1.0 Ga Ga15 1 0.62353848 0.12548751 0.12548751 1.0 Ga Ga16 1 0.12796353 0.63792614 0.11705516 1.0 Ni Ni17 1 0.91265869 0.91663574 0.91663574 1.0 Ni Ni18 1 0.33355469 0.33605201 0.99434028 1.0 Ni Ni19 1 0.91265869 0.91663574 0.25406983 1.0 Ni Ni20 1 0.27052531 0.90982456 0.90982456 1.0 Ni Ni21 1 0.33355469 0.99434028 0.33605201 1.0 Ni Ni22 1 0.91265869 0.25406983 0.91663574 1.0 Ni Ni23 1 0.33355469 0.33605201 0.33605201 1.0 N N24 1 0.61996803 0.12399610 0.62801793 1.0 N N25 1 0.61996803 0.62801793 0.12399610 1.0 N N26 1 0.12703413 0.62432262 0.62432262 1.0 N N27 1 0.61996803 0.62801793 0.62801793 1.0