# generated using pymatgen data_Tm16Sc4SiBi11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.96057184 _cell_length_b 9.21166573 _cell_length_c 11.73518509 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.76432089 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm16Sc4SiBi11 _chemical_formula_sum 'Tm16 Sc4 Si1 Bi11' _cell_volume 860.53533068 _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 0.35370656 0.25000000 0.29684596 1.0 Tm Tm1 1 0.65073657 0.75000000 0.71530507 1.0 Tm Tm2 1 0.14464141 0.75000000 0.78217700 1.0 Tm Tm3 1 0.85345404 0.25000000 0.21496640 1.0 Tm Tm4 1 0.19151180 0.25000000 0.77438627 1.0 Tm Tm5 1 0.81410167 0.75000000 0.21893959 1.0 Tm Tm6 1 0.31642401 0.75000000 0.28146477 1.0 Tm Tm7 1 0.66540149 0.25000000 0.70820794 1.0 Tm Tm8 1 0.19685166 0.06648538 0.06100344 1.0 Tm Tm9 1 0.80352062 0.93482699 0.94139504 1.0 Tm Tm10 1 0.30825194 0.95085127 0.55869981 1.0 Tm Tm11 1 0.80352062 0.56517301 0.94139504 1.0 Tm Tm12 1 0.68582615 0.07270312 0.44556935 1.0 Tm Tm13 1 0.19685166 0.43351462 0.06100344 1.0 Tm Tm14 1 0.68582615 0.42729688 0.44556935 1.0 Tm Tm15 1 0.30825194 0.54914873 0.55869981 1.0 Sc Sc16 1 0.03489218 0.25000000 0.51125744 1.0 Sc Sc17 1 0.98214897 0.75000000 0.49041931 1.0 Sc Sc18 1 0.47695198 0.75000000 0.01325865 1.0 Sc Sc19 1 0.52519059 0.25000000 0.98702128 1.0 Si Si20 1 0.40612312 0.25000000 0.53610815 1.0 Bi Bi21 1 0.59739736 0.75000000 0.45879640 1.0 Bi Bi22 1 0.09757501 0.75000000 0.04119212 1.0 Bi Bi23 1 0.90671300 0.25000000 0.95448202 1.0 Bi Bi24 1 0.06294804 0.00279334 0.33004278 1.0 Bi Bi25 1 0.93440595 0.99897295 0.67008575 1.0 Bi Bi26 1 0.43485575 0.99469609 0.82936460 1.0 Bi Bi27 1 0.93440595 0.50102705 0.67008575 1.0 Bi Bi28 1 0.56485348 0.00551248 0.17143054 1.0 Bi Bi29 1 0.06294804 0.49720666 0.33004278 1.0 Bi Bi30 1 0.56485348 0.49448752 0.17143054 1.0 Bi Bi31 1 0.43485575 0.50530391 0.82936460 1.0