# generated using pymatgen data_Ti6SiGeN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.43699401 _cell_length_b 5.43699364 _cell_length_c 8.06781881 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 146.29559755 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti6SiGeN2 _chemical_formula_sum 'Ti6 Si1 Ge1 N2' _cell_volume 132.34120247 _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 Ti Ti0 1 0.62943134 0.37056866 0.55177144 1.0 Ti Ti1 1 0.37158301 0.62841699 0.04527890 1.0 Ti Ti2 1 0.37158301 0.62841699 0.45472110 1.0 Ti Ti3 1 0.62943134 0.37056866 0.94822856 1.0 Ti Ti4 1 0.94843223 0.05156777 0.75000000 1.0 Ti Ti5 1 0.04838977 0.95161023 0.25000000 1.0 Si Si6 1 0.25458182 0.74541818 0.75000000 1.0 Ge Ge7 1 0.74613685 0.25386315 0.25000000 1.0 N N8 1 0.00021531 0.99978469 0.50024949 1.0 N N9 1 0.00021531 0.99978469 0.99975051 1.0