# generated using pymatgen data_Ti4Si3TcN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.34622963 _cell_length_b 7.34622850 _cell_length_c 5.09164245 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999621 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti4Si3TcN _chemical_formula_sum 'Ti8 Si6 Tc2 N2' _cell_volume 237.96740755 _cell_formula_units_Z 2 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 0.22917157 1.00000000 0.74849636 1.0 Ti Ti1 1 0.77082843 0.00000000 0.25150364 1.0 Ti Ti2 1 0.00000000 0.22917157 0.74849636 1.0 Ti Ti3 1 1.00000000 0.77082843 0.25150364 1.0 Ti Ti4 1 0.77082843 0.77082843 0.74849636 1.0 Ti Ti5 1 0.22917157 0.22917157 0.25150364 1.0 Ti Ti6 1 0.33333300 0.66666700 0.50000000 1.0 Ti Ti7 1 0.66666700 0.33333300 0.50000000 1.0 Si Si8 1 0.58961087 0.00000000 0.76191068 1.0 Si Si9 1 0.41038913 1.00000000 0.23808932 1.0 Si Si10 1 1.00000000 0.58961087 0.76191068 1.0 Si Si11 1 0.00000000 0.41038913 0.23808932 1.0 Si Si12 1 0.41038913 0.41038913 0.76191068 1.0 Si Si13 1 0.58961087 0.58961087 0.23808932 1.0 Tc Tc14 1 0.66666700 0.33333300 0.00000000 1.0 Tc Tc15 1 0.33333300 0.66666700 0.00000000 1.0 N N16 1 0.00000000 0.00000000 0.50000000 1.0 N N17 1 0.00000000 0.00000000 0.00000000 1.0