# generated using pymatgen data_Ta12Ga5Pd3N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.98940541 _cell_length_b 6.98940575 _cell_length_c 6.98940579 _cell_angle_alpha 90.28827320 _cell_angle_beta 90.28827182 _cell_angle_gamma 90.28827415 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta12Ga5Pd3N4 _chemical_formula_sum 'Ta12 Ga5 Pd3 N4' _cell_volume 341.43197757 _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 0.78985682 0.95591703 0.37939832 1.0 Ta Ta1 1 0.70884542 0.04295322 0.87362907 1.0 Ta Ta2 1 0.21035139 0.45461603 0.12281109 1.0 Ta Ta3 1 0.29124473 0.54536327 0.62266662 1.0 Ta Ta4 1 0.95591703 0.37939832 0.78985682 1.0 Ta Ta5 1 0.04295322 0.87362907 0.70884542 1.0 Ta Ta6 1 0.45461603 0.12281109 0.21035139 1.0 Ta Ta7 1 0.54536327 0.62266662 0.29124473 1.0 Ta Ta8 1 0.37939832 0.78985682 0.95591703 1.0 Ta Ta9 1 0.87362907 0.70884542 0.04295322 1.0 Ta Ta10 1 0.12281109 0.21035139 0.45461603 1.0 Ta Ta11 1 0.62266662 0.29124473 0.54536327 1.0 Ga Ga12 1 0.67796860 0.67796860 0.67796860 1.0 Ga Ga13 1 0.57015038 0.42313373 0.93410902 1.0 Ga Ga14 1 0.42313373 0.93410902 0.57015038 1.0 Ga Ga15 1 0.93410902 0.57015038 0.42313373 1.0 Ga Ga16 1 0.07171220 0.07171220 0.07171220 1.0 Pd Pd17 1 0.17969803 0.82140297 0.31774652 1.0 Pd Pd18 1 0.31774652 0.17969803 0.82140297 1.0 Pd Pd19 1 0.82140297 0.31774652 0.17969803 1.0 N N20 1 0.87871303 0.12723866 0.62584164 1.0 N N21 1 0.62584164 0.87871303 0.12723866 1.0 N N22 1 0.12723866 0.62584164 0.87871303 1.0 N N23 1 0.37463622 0.37463622 0.37463622 1.0