# generated using pymatgen data_Tm8Ta9Ti3Ge16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.93339482 _cell_length_b 7.07497246 _cell_length_c 13.36888105 _cell_angle_alpha 89.97258941 _cell_angle_beta 90.02449726 _cell_angle_gamma 89.91564797 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Ta9Ti3Ge16 _chemical_formula_sum 'Tm8 Ta9 Ti3 Ge16' _cell_volume 655.79059493 _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 Tm Tm0 1 0.49412075 0.67374601 0.59482519 1.0 Tm Tm1 1 0.99358781 0.82596235 0.90511684 1.0 Tm Tm2 1 0.50564290 0.32594549 0.09484359 1.0 Tm Tm3 1 0.00638343 0.17431073 0.40513187 1.0 Tm Tm4 1 0.50495308 0.32631089 0.40395759 1.0 Tm Tm5 1 0.00381784 0.17585059 0.09612398 1.0 Tm Tm6 1 0.49661089 0.67564376 0.90368700 1.0 Tm Tm7 1 0.99576470 0.82338305 0.59554298 1.0 Ta Ta8 1 0.83958195 0.67184194 0.37338644 1.0 Ta Ta9 1 0.34345087 0.82658349 0.37279333 1.0 Ta Ta10 1 0.84128329 0.67136644 0.12690599 1.0 Ta Ta11 1 0.65736924 0.17287580 0.87267435 1.0 Ta Ta12 1 0.15743455 0.32688070 0.62772758 1.0 Ta Ta13 1 0.83264190 0.48872034 0.75020893 1.0 Ta Ta14 1 0.33294966 0.01237373 0.74999499 1.0 Ta Ta15 1 0.16582560 0.51236678 0.25067267 1.0 Ta Ta16 1 0.66790924 0.98699985 0.25080261 1.0 Ti Ti17 1 0.65905500 0.17118994 0.62640496 1.0 Ti Ti18 1 0.16134341 0.32875181 0.87391213 1.0 Ti Ti19 1 0.33988896 0.82935475 0.12598524 1.0 Ge Ge20 1 0.67775985 0.96427171 0.46001675 1.0 Ge Ge21 1 0.17752107 0.53967554 0.04150443 1.0 Ge Ge22 1 0.32266405 0.03873959 0.95866717 1.0 Ge Ge23 1 0.82141206 0.45920669 0.54188798 1.0 Ge Ge24 1 0.32439580 0.03736507 0.54165797 1.0 Ge Ge25 1 0.82502928 0.46125280 0.95831140 1.0 Ge Ge26 1 0.67602346 0.96137308 0.04134917 1.0 Ge Ge27 1 0.17572653 0.53806339 0.45909328 1.0 Ge Ge28 1 0.45822161 0.37919236 0.74880253 1.0 Ge Ge29 1 0.95766549 0.12170370 0.75158678 1.0 Ge Ge30 1 0.53963651 0.62005010 0.24742382 1.0 Ge Ge31 1 0.04372037 0.88065978 0.24920506 1.0 Ge Ge32 1 0.69289380 0.86087108 0.74840106 1.0 Ge Ge33 1 0.19288030 0.63921518 0.75169862 1.0 Ge Ge34 1 0.30793114 0.13929000 0.24899519 1.0 Ge Ge35 1 0.80690162 0.35861248 0.25070251 1.0