# generated using pymatgen data_Tm8Nb9Si16Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.75156874 _cell_length_b 6.99497849 _cell_length_c 13.24544843 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.98761580 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Nb9Si16Mo3 _chemical_formula_sum 'Tm8 Nb9 Si16 Mo3' _cell_volume 625.54381246 _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 0.50226304 0.32732831 0.09546466 1.0 Tm Tm1 1 0.00224671 0.17294590 0.40433253 1.0 Tm Tm2 1 0.49709831 0.67253300 0.59561227 1.0 Tm Tm3 1 0.99719671 0.82706845 0.90455958 1.0 Tm Tm4 1 0.49709831 0.67253300 0.90438773 1.0 Tm Tm5 1 0.99719671 0.82706845 0.59544042 1.0 Tm Tm6 1 0.50226304 0.32732831 0.40453534 1.0 Tm Tm7 1 0.00224671 0.17294590 0.09566747 1.0 Nb Nb8 1 0.83571165 0.32672596 0.62534264 1.0 Nb Nb9 1 0.33528605 0.17492225 0.87494985 1.0 Nb Nb10 1 0.16461417 0.67311831 0.12597474 1.0 Nb Nb11 1 0.66523830 0.82660200 0.37349800 1.0 Nb Nb12 1 0.16461417 0.67311831 0.37402526 1.0 Nb Nb13 1 0.66523830 0.82660200 0.12650200 1.0 Nb Nb14 1 0.83571165 0.32672596 0.87465736 1.0 Nb Nb15 1 0.33528605 0.17492225 0.62505015 1.0 Nb Nb16 1 0.66194635 0.00750268 0.75000000 1.0 Si Si17 1 0.66437695 0.03632350 0.54011353 1.0 Si Si18 1 0.16429148 0.46285998 0.95879663 1.0 Si Si19 1 0.33618017 0.96297125 0.04184007 1.0 Si Si20 1 0.83564329 0.53714390 0.45864469 1.0 Si Si21 1 0.33618017 0.96297125 0.45815993 1.0 Si Si22 1 0.83564329 0.53714390 0.04135531 1.0 Si Si23 1 0.66437695 0.03632350 0.95988647 1.0 Si Si24 1 0.16429148 0.46285998 0.54120337 1.0 Si Si25 1 0.53512561 0.38203921 0.75000000 1.0 Si Si26 1 0.04014767 0.12042514 0.75000000 1.0 Si Si27 1 0.46388456 0.61945757 0.25000000 1.0 Si Si28 1 0.96482723 0.88126491 0.25000000 1.0 Si Si29 1 0.79783040 0.62750014 0.75000000 1.0 Si Si30 1 0.29348376 0.86774394 0.75000000 1.0 Si Si31 1 0.20201085 0.36981490 0.25000000 1.0 Si Si32 1 0.70211710 0.13073194 0.25000000 1.0 Mo Mo33 1 0.16099157 0.49185578 0.75000000 1.0 Mo Mo34 1 0.33875918 0.99250246 0.25000000 1.0 Mo Mo35 1 0.83858608 0.50808173 0.25000000 1.0