# generated using pymatgen data_Tm8Nb9Ge16Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.88027828 _cell_length_b 7.09437564 _cell_length_c 13.40966438 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.98208924 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Nb9Ge16Mo3 _chemical_formula_sum 'Tm8 Nb9 Ge16 Mo3' _cell_volume 654.54283272 _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 0.49501010 0.32379457 0.09397854 1.0 Tm Tm1 1 0.99474453 0.17654167 0.40587085 1.0 Tm Tm2 1 0.50449256 0.67569075 0.59408328 1.0 Tm Tm3 1 0.00441151 0.82355907 0.90582143 1.0 Tm Tm4 1 0.50449256 0.67569075 0.90591672 1.0 Tm Tm5 1 0.00441151 0.82355907 0.59417857 1.0 Tm Tm6 1 0.49501010 0.32379457 0.40602146 1.0 Tm Tm7 1 0.99474453 0.17654167 0.09412915 1.0 Nb Nb8 1 0.84044513 0.33175460 0.62637831 1.0 Nb Nb9 1 0.33948473 0.16954441 0.87408112 1.0 Nb Nb10 1 0.15988436 0.66796583 0.12713362 1.0 Nb Nb11 1 0.66052060 0.83220590 0.37233891 1.0 Nb Nb12 1 0.15988436 0.66796583 0.37286638 1.0 Nb Nb13 1 0.66052060 0.83220590 0.12766109 1.0 Nb Nb14 1 0.84044513 0.33175460 0.87362169 1.0 Nb Nb15 1 0.33948473 0.16954441 0.62591888 1.0 Nb Nb16 1 0.66504519 0.01199478 0.75000000 1.0 Ge Ge17 1 0.67762141 0.03884226 0.54108417 1.0 Ge Ge18 1 0.17755835 0.46039841 0.95809231 1.0 Ge Ge19 1 0.32279178 0.96018748 0.04273584 1.0 Ge Ge20 1 0.82229529 0.54025923 0.45763878 1.0 Ge Ge21 1 0.32279178 0.96018748 0.45726416 1.0 Ge Ge22 1 0.82229529 0.54025923 0.04236122 1.0 Ge Ge23 1 0.67762141 0.03884226 0.95891583 1.0 Ge Ge24 1 0.17755835 0.46039841 0.54190769 1.0 Ge Ge25 1 0.53493079 0.38283362 0.75000000 1.0 Ge Ge26 1 0.04032389 0.11894694 0.75000000 1.0 Ge Ge27 1 0.46371835 0.61810655 0.25000000 1.0 Ge Ge28 1 0.96472789 0.88276722 0.25000000 1.0 Ge Ge29 1 0.80662967 0.63955463 0.75000000 1.0 Ge Ge30 1 0.30418466 0.85555135 0.75000000 1.0 Ge Ge31 1 0.19326658 0.35735496 0.25000000 1.0 Ge Ge32 1 0.69309860 0.14322039 0.25000000 1.0 Mo Mo33 1 0.16380435 0.48753863 0.75000000 1.0 Mo Mo34 1 0.33598242 0.98757863 0.25000000 1.0 Mo Mo35 1 0.83576791 0.51306393 0.25000000 1.0