# generated using pymatgen data_Tm8Ti11NbSi16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.99530571 _cell_length_b 6.99530587 _cell_length_c 12.83872865 _cell_angle_alpha 89.97780070 _cell_angle_beta 90.02219932 _cell_angle_gamma 90.04992008 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm8Ti11NbSi16 _chemical_formula_sum 'Tm8 Ti11 Nb1 Si16' _cell_volume 628.25390613 _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 0.34116231 0.00046925 0.46645699 1.0 Tm Tm1 1 0.49953598 0.84039379 0.71636506 1.0 Tm Tm2 1 0.50011181 0.15883341 0.21615242 1.0 Tm Tm3 1 0.84039379 0.49953598 0.28363494 1.0 Tm Tm4 1 0.15883341 0.50011181 0.78384758 1.0 Tm Tm5 1 0.65833233 0.99970337 0.96641649 1.0 Tm Tm6 1 0.00046925 0.34116231 0.53354301 1.0 Tm Tm7 1 0.99970337 0.65833233 0.03358351 1.0 Ti Ti8 1 0.17217275 0.82762349 0.25014634 1.0 Ti Ti9 1 0.82762349 0.17217275 0.74985366 1.0 Ti Ti10 1 0.67204195 0.67204195 0.50000000 1.0 Ti Ti11 1 0.15307973 0.00898462 0.87640497 1.0 Ti Ti12 1 0.49223017 0.65073281 0.12502583 1.0 Ti Ti13 1 0.50769116 0.34922101 0.62525512 1.0 Ti Ti14 1 0.65073281 0.49223017 0.87497417 1.0 Ti Ti15 1 0.34922101 0.50769116 0.37474488 1.0 Ti Ti16 1 0.84812984 0.99238328 0.37594196 1.0 Ti Ti17 1 0.00898462 0.15307973 0.12359503 1.0 Ti Ti18 1 0.99238328 0.84812984 0.62405804 1.0 Nb Nb19 1 0.32711917 0.32711917 0.00000000 1.0 Si Si20 1 0.20466073 0.13144350 0.68232166 1.0 Si Si21 1 0.36770824 0.70497528 0.93261874 1.0 Si Si22 1 0.63235484 0.29538624 0.43272652 1.0 Si Si23 1 0.70497528 0.36770824 0.06738126 1.0 Si Si24 1 0.29538624 0.63235484 0.56727348 1.0 Si Si25 1 0.79594343 0.86825148 0.18298481 1.0 Si Si26 1 0.13144350 0.20466073 0.31767834 1.0 Si Si27 1 0.86825148 0.79594343 0.81701519 1.0 Si Si28 1 0.29237250 0.95133829 0.06427427 1.0 Si Si29 1 0.54774335 0.79199270 0.31401587 1.0 Si Si30 1 0.45380369 0.20689219 0.81261759 1.0 Si Si31 1 0.79199270 0.54774335 0.68598413 1.0 Si Si32 1 0.20689219 0.45380369 0.18738241 1.0 Si Si33 1 0.70787907 0.04730324 0.56404667 1.0 Si Si34 1 0.95133829 0.29237250 0.93572573 1.0 Si Si35 1 0.04730324 0.70787907 0.43595333 1.0