# generated using pymatgen data_Ti16Ga3Si9Tc4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.04664083 _cell_length_b 7.41263587 _cell_length_c 12.86461398 _cell_angle_alpha 90.03768413 _cell_angle_beta 90.06926046 _cell_angle_gamma 89.92480492 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti16Ga3Si9Tc4 _chemical_formula_sum 'Ti16 Ga3 Si9 Tc4' _cell_volume 481.25032833 _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 0.25075907 0.49606448 0.83138588 1.0 Ti Ti1 1 0.24999261 0.00211451 0.33098082 1.0 Ti Ti2 1 0.25138246 0.00388826 0.66713584 1.0 Ti Ti3 1 0.24938191 0.50154914 0.16925939 1.0 Ti Ti4 1 0.49849912 0.25654948 0.49956347 1.0 Ti Ti5 1 0.49661909 0.75616580 0.00237791 1.0 Ti Ti6 1 0.49681317 0.61969066 0.62314920 1.0 Ti Ti7 1 0.49314874 0.12091119 0.12476179 1.0 Ti Ti8 1 0.49334447 0.12426552 0.87575117 1.0 Ti Ti9 1 0.49324119 0.62129176 0.37517274 1.0 Ti Ti10 1 0.99917351 0.74357231 0.50013811 1.0 Ti Ti11 1 0.99941582 0.24176117 0.99993731 1.0 Ti Ti12 1 0.99976668 0.87696311 0.87860651 1.0 Ti Ti13 1 0.00704109 0.37705188 0.37613354 1.0 Ti Ti14 1 0.00719658 0.37604702 0.62380746 1.0 Ti Ti15 1 0.00537601 0.87621811 0.12372247 1.0 Ga Ga16 1 0.50724535 0.39560849 0.00086141 1.0 Ga Ga17 1 0.50590587 0.89445933 0.49953816 1.0 Ga Ga18 1 0.50834779 0.80145104 0.80271958 1.0 Si Si19 1 0.51658156 0.30266722 0.30273342 1.0 Si Si20 1 0.51915502 0.30234392 0.69667275 1.0 Si Si21 1 0.51632276 0.80244755 0.19802445 1.0 Si Si22 1 0.98735303 0.60302653 0.99955564 1.0 Si Si23 1 0.98814555 0.10475394 0.49912636 1.0 Si Si24 1 0.98700340 0.69944982 0.69721629 1.0 Si Si25 1 0.98468259 0.19886233 0.19578337 1.0 Si Si26 1 0.98457349 0.19496819 0.80380155 1.0 Si Si27 1 0.98535140 0.69933540 0.30431039 1.0 Tc Tc28 1 0.75640178 0.00506835 0.66619129 1.0 Tc Tc29 1 0.75257983 0.50256823 0.17009922 1.0 Tc Tc30 1 0.75646589 0.49596583 0.83110669 1.0 Tc Tc31 1 0.75273417 0.00290542 0.33037283 1.0