# generated using pymatgen data_Tm20NiBi8Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.88832867 _cell_length_b 8.81203946 _cell_length_c 12.30020164 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.39184732 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm20NiBi8Ru3 _chemical_formula_sum 'Tm20 Ni1 Bi8 Ru3' _cell_volume 854.99486163 _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 0.83902507 0.75000000 0.79606227 1.0 Tm Tm1 1 0.16154509 0.25000000 0.20721033 1.0 Tm Tm2 1 0.34160384 0.25000000 0.70545210 1.0 Tm Tm3 1 0.65589083 0.75000000 0.29756401 1.0 Tm Tm4 1 0.37697485 0.75000000 0.68963102 1.0 Tm Tm5 1 0.62087804 0.25000000 0.31204906 1.0 Tm Tm6 1 0.87785296 0.25000000 0.81131512 1.0 Tm Tm7 1 0.12037697 0.75000000 0.18464469 1.0 Tm Tm8 1 0.94393432 0.75000000 0.50323449 1.0 Tm Tm9 1 0.05608309 0.25000000 0.49667225 1.0 Tm Tm10 1 0.44559875 0.25000000 0.99783129 1.0 Tm Tm11 1 0.55672502 0.75000000 0.00179665 1.0 Tm Tm12 1 0.67198869 0.03873080 0.56539974 1.0 Tm Tm13 1 0.32621100 0.95980263 0.43465071 1.0 Tm Tm14 1 0.17437546 0.96026126 0.93453215 1.0 Tm Tm15 1 0.32621100 0.54019737 0.43465071 1.0 Tm Tm16 1 0.82853275 0.03993403 0.06441603 1.0 Tm Tm17 1 0.67198869 0.46126920 0.56539974 1.0 Tm Tm18 1 0.82853275 0.46006597 0.06441603 1.0 Tm Tm19 1 0.17437546 0.53973874 0.93453215 1.0 Ni Ni20 1 0.92952718 0.75000000 0.00684033 1.0 Bi Bi21 1 0.56678701 0.49150703 0.82852497 1.0 Bi Bi22 1 0.43500854 0.50960005 0.17103608 1.0 Bi Bi23 1 0.06399291 0.50806524 0.67335247 1.0 Bi Bi24 1 0.43500854 0.99039995 0.17103608 1.0 Bi Bi25 1 0.93536068 0.49305687 0.32611012 1.0 Bi Bi26 1 0.56678701 0.00849297 0.82852497 1.0 Bi Bi27 1 0.93536068 0.00694313 0.32611012 1.0 Bi Bi28 1 0.06399291 0.99193476 0.67335247 1.0 Ru Ru29 1 0.56977160 0.75000000 0.51007348 1.0 Ru Ru30 1 0.42918136 0.25000000 0.49155933 1.0 Ru Ru31 1 0.07051793 0.25000000 0.99202103 1.0