# generated using pymatgen data_Mn3Nb12Ga9N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.27250257 _cell_length_b 8.26475783 _cell_length_c 8.26475777 _cell_angle_alpha 59.99999626 _cell_angle_beta 60.03096071 _cell_angle_gamma 60.03096762 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn3Nb12Ga9N4 _chemical_formula_sum 'Mn3 Nb12 Ga9 N4' _cell_volume 399.74704686 _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 Mn Mn0 1 0.62500000 0.12500000 0.62500000 1.0 Mn Mn1 1 0.62500000 0.62500000 0.12500000 1.0 Mn Mn2 1 0.62500000 0.62500000 0.62500000 1.0 Nb Nb3 1 0.81065112 0.80730374 0.19102357 1.0 Nb Nb4 1 0.19145365 0.19656774 0.80598981 1.0 Nb Nb5 1 0.81065112 0.19102357 0.80730374 1.0 Nb Nb6 1 0.19145365 0.80598981 0.19656774 1.0 Nb Nb7 1 0.19145365 0.80598981 0.80598981 1.0 Nb Nb8 1 0.81065112 0.19102357 0.19102357 1.0 Nb Nb9 1 0.43934888 0.44269626 0.05897643 1.0 Nb Nb10 1 0.05854635 0.05343226 0.44401019 1.0 Nb Nb11 1 0.43934888 0.05897643 0.44269626 1.0 Nb Nb12 1 0.05854635 0.44401019 0.05343226 1.0 Nb Nb13 1 0.05854635 0.44401019 0.44401019 1.0 Nb Nb14 1 0.43934888 0.05897643 0.05897643 1.0 Ga Ga15 1 0.12500000 0.62500000 0.62500000 1.0 Ga Ga16 1 0.76652180 0.41115973 0.41115973 1.0 Ga Ga17 1 0.42078438 0.76032999 0.40944331 1.0 Ga Ga18 1 0.42078438 0.40944331 0.76032999 1.0 Ga Ga19 1 0.42078438 0.40944331 0.40944331 1.0 Ga Ga20 1 0.48347820 0.83884027 0.83884027 1.0 Ga Ga21 1 0.82921562 0.48967001 0.84055669 1.0 Ga Ga22 1 0.82921562 0.84055669 0.48967001 1.0 Ga Ga23 1 0.82921562 0.84055669 0.84055669 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