# generated using pymatgen data_Lu8Ti7Ge16Mo5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.81929552 _cell_length_b 6.99959042 _cell_length_c 13.19394116 _cell_angle_alpha 89.95943469 _cell_angle_beta 89.90535148 _cell_angle_gamma 89.96094018 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu8Ti7Ge16Mo5 _chemical_formula_sum 'Lu8 Ti7 Ge16 Mo5' _cell_volume 629.77567295 _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 Lu Lu0 1 0.00368029 0.17439590 0.40515228 1.0 Lu Lu1 1 0.50420417 0.32292976 0.09562948 1.0 Lu Lu2 1 0.49602626 0.67492361 0.59578240 1.0 Lu Lu3 1 0.99552376 0.82444509 0.90423566 1.0 Lu Lu4 1 0.99628097 0.82494836 0.59626245 1.0 Lu Lu5 1 0.49466387 0.67626161 0.90657647 1.0 Lu Lu6 1 0.50303154 0.32566594 0.40331272 1.0 Lu Lu7 1 0.00592734 0.17201266 0.09522460 1.0 Ti Ti8 1 0.83888503 0.66990751 0.37082993 1.0 Ti Ti9 1 0.66169677 0.16841717 0.62708708 1.0 Ti Ti10 1 0.16095235 0.33089259 0.87375631 1.0 Ti Ti11 1 0.16085328 0.33193676 0.62695980 1.0 Ti Ti12 1 0.66021526 0.16893868 0.87325948 1.0 Ti Ti13 1 0.84284916 0.66985605 0.12743690 1.0 Ti Ti14 1 0.33740906 0.83112870 0.37163063 1.0 Ge Ge15 1 0.32507733 0.04151184 0.54241391 1.0 Ge Ge16 1 0.82440216 0.45910960 0.95820914 1.0 Ge Ge17 1 0.67247405 0.95845223 0.04272054 1.0 Ge Ge18 1 0.17509222 0.54233070 0.45732095 1.0 Ge Ge19 1 0.17709242 0.54100076 0.04243935 1.0 Ge Ge20 1 0.67366921 0.95865840 0.45732086 1.0 Ge Ge21 1 0.82624990 0.45906144 0.54286579 1.0 Ge Ge22 1 0.32255692 0.04249805 0.95833723 1.0 Ge Ge23 1 0.80647792 0.36131867 0.24923273 1.0 Ge Ge24 1 0.30689218 0.13848377 0.25057058 1.0 Ge Ge25 1 0.69481131 0.86123874 0.75009329 1.0 Ge Ge26 1 0.19536851 0.63763526 0.75033403 1.0 Ge Ge27 1 0.03826826 0.87872967 0.25058897 1.0 Ge Ge28 1 0.53664930 0.62439753 0.24864842 1.0 Ge Ge29 1 0.46221827 0.37605390 0.75019274 1.0 Ge Ge30 1 0.96320553 0.12316673 0.75034844 1.0 Mo Mo31 1 0.33616905 0.83235558 0.12655793 1.0 Mo Mo32 1 0.33497921 0.00829491 0.75048892 1.0 Mo Mo33 1 0.66620572 0.98880039 0.24903816 1.0 Mo Mo34 1 0.16446331 0.51126470 0.24874297 1.0 Mo Mo35 1 0.83547414 0.48897577 0.75039987 1.0