# generated using pymatgen data_Tm11Cd45 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.38242355 _cell_length_b 15.38242355 _cell_length_c 15.38242355 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm11Cd45 _chemical_formula_sum 'Tm22 Cd90' _cell_volume 2573.70814996 _cell_formula_units_Z 2 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 0.00000000 0.00000000 0.00000000 1.0 Tm Tm1 1 0.01370400 0.33379100 0.63880200 1.0 Tm Tm2 1 0.01370400 0.01370400 0.63880200 1.0 Tm Tm3 1 0.33379100 0.01370400 0.63880200 1.0 Tm Tm4 1 0.01370400 0.63880200 0.33379100 1.0 Tm Tm5 1 0.33379100 0.63880200 0.01370400 1.0 Tm Tm6 1 0.01370400 0.63880200 0.01370400 1.0 Tm Tm7 1 0.63880200 0.01370400 0.01370400 1.0 Tm Tm8 1 0.63880200 0.33379100 0.01370400 1.0 Tm Tm9 1 0.63880200 0.01370400 0.33379100 1.0 Tm Tm10 1 0.33379100 0.01370400 0.01370400 1.0 Tm Tm11 1 0.01370400 0.01370400 0.33379100 1.0 Tm Tm12 1 0.01370400 0.33379100 0.01370400 1.0 Tm Tm13 1 0.25000000 0.25000000 0.25000000 1.0 Tm Tm14 1 0.40644000 0.40644000 0.78068100 1.0 Tm Tm15 1 0.40644000 0.78068100 0.40644000 1.0 Tm Tm16 1 0.78068100 0.40644000 0.40644000 1.0 Tm Tm17 1 0.40644000 0.40644000 0.40644000 1.0 Tm Tm18 1 0.66166400 0.66166400 0.01500800 1.0 Tm Tm19 1 0.66166400 0.01500800 0.66166400 1.0 Tm Tm20 1 0.01500800 0.66166400 0.66166400 1.0 Tm Tm21 1 0.66166400 0.66166400 0.66166400 1.0 Cd Cd22 1 0.08342800 0.08342800 0.74971700 1.0 Cd Cd23 1 0.08342800 0.74971700 0.08342800 1.0 Cd Cd24 1 0.74971700 0.08342800 0.08342800 1.0 Cd Cd25 1 0.08342800 0.08342800 0.08342800 1.0 Cd Cd26 1 0.91345700 0.91345700 0.25963000 1.0 Cd Cd27 1 0.91345700 0.25963000 0.91345700 1.0 Cd Cd28 1 0.25963000 0.91345700 0.91345700 1.0 Cd Cd29 1 0.91345700 0.91345700 0.91345700 1.0 Cd Cd30 1 0.15598600 0.15598600 0.84401400 1.0 Cd Cd31 1 0.84401400 0.15598600 0.84401400 1.0 Cd Cd32 1 0.15598600 0.84401400 0.84401400 1.0 Cd Cd33 1 0.84401400 0.84401400 0.15598600 1.0 Cd Cd34 1 0.15598600 0.84401400 0.15598600 1.0 Cd Cd35 1 0.84401400 0.15598600 0.15598600 1.0 Cd Cd36 1 0.39084700 0.20089500 0.01741100 1.0 Cd Cd37 1 0.39084700 0.39084700 0.01741100 1.0 Cd Cd38 1 0.20089500 0.39084700 0.01741100 1.0 Cd Cd39 1 0.39084700 0.01741100 0.20089500 1.0 Cd Cd40 1 0.20089500 0.01741100 0.39084700 1.0 Cd Cd41 1 0.39084700 0.01741100 0.39084700 1.0 Cd Cd42 1 0.01741100 0.39084700 0.39084700 1.0 Cd Cd43 1 0.01741100 0.20089500 0.39084700 1.0 Cd Cd44 1 0.01741100 0.39084700 0.20089500 1.0 Cd Cd45 1 0.20089500 0.39084700 0.39084700 1.0 Cd Cd46 1 0.39084700 0.39084700 0.20089500 1.0 Cd Cd47 1 0.39084700 0.20089500 0.39084700 1.0 Cd Cd48 1 0.16322700 0.16322700 0.51032000 1.0 Cd Cd49 1 0.16322700 0.51032000 0.16322700 1.0 Cd Cd50 1 0.51032000 0.16322700 0.16322700 1.0 Cd Cd51 1 0.16322700 0.16322700 0.16322700 1.0 Cd Cd52 1 0.26313900 0.61050400 0.86321800 1.0 Cd Cd53 1 0.26313900 0.26313900 0.86321800 1.0 Cd Cd54 1 0.61050400 0.26313900 0.86321800 1.0 Cd Cd55 1 0.26313900 0.86321800 0.61050400 1.0 Cd Cd56 1 0.61050400 0.86321800 0.26313900 1.0 Cd Cd57 1 0.26313900 0.86321800 0.26313900 1.0 Cd Cd58 1 0.86321800 0.26313900 0.26313900 1.0 Cd Cd59 1 0.86321800 0.61050400 0.26313900 1.0 Cd Cd60 1 0.86321800 0.26313900 0.61050400 1.0 Cd Cd61 1 0.61050400 0.26313900 0.26313900 1.0 Cd Cd62 1 0.26313900 0.26313900 0.61050400 1.0 Cd Cd63 1 0.26313900 0.61050400 0.26313900 1.0 Cd Cd64 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd65 1 0.64052900 0.45005200 0.26889000 1.0 Cd Cd66 1 0.64052900 0.64052900 0.26889000 1.0 Cd Cd67 1 0.45005200 0.64052900 0.26889000 1.0 Cd Cd68 1 0.64052900 0.26889000 0.45005200 1.0 Cd Cd69 1 0.45005200 0.26889000 0.64052900 1.0 Cd Cd70 1 0.64052900 0.26889000 0.64052900 1.0 Cd Cd71 1 0.26889000 0.64052900 0.64052900 1.0 Cd Cd72 1 0.26889000 0.45005200 0.64052900 1.0 Cd Cd73 1 0.26889000 0.64052900 0.45005200 1.0 Cd Cd74 1 0.45005200 0.64052900 0.64052900 1.0 Cd Cd75 1 0.64052900 0.64052900 0.45005200 1.0 Cd Cd76 1 0.64052900 0.45005200 0.64052900 1.0 Cd Cd77 1 0.51279000 0.83326100 0.14115900 1.0 Cd Cd78 1 0.51279000 0.51279000 0.14115900 1.0 Cd Cd79 1 0.83326100 0.51279000 0.14115900 1.0 Cd Cd80 1 0.51279000 0.14115900 0.83326100 1.0 Cd Cd81 1 0.83326100 0.14115900 0.51279000 1.0 Cd Cd82 1 0.51279000 0.14115900 0.51279000 1.0 Cd Cd83 1 0.14115900 0.51279000 0.51279000 1.0 Cd Cd84 1 0.14115900 0.83326100 0.51279000 1.0 Cd Cd85 1 0.14115900 0.51279000 0.83326100 1.0 Cd Cd86 1 0.83326100 0.51279000 0.51279000 1.0 Cd Cd87 1 0.51279000 0.51279000 0.83326100 1.0 Cd Cd88 1 0.51279000 0.83326100 0.51279000 1.0 Cd Cd89 1 0.75000000 0.75000000 0.75000000 1.0 Cd Cd90 1 0.83010500 0.83010500 0.50968500 1.0 Cd Cd91 1 0.83010500 0.50968500 0.83010500 1.0 Cd Cd92 1 0.50968500 0.83010500 0.83010500 1.0 Cd Cd93 1 0.83010500 0.83010500 0.83010500 1.0 Cd Cd94 1 0.91119300 0.91119300 0.58880700 1.0 Cd Cd95 1 0.58880700 0.91119300 0.58880700 1.0 Cd Cd96 1 0.91119300 0.58880700 0.58880700 1.0 Cd Cd97 1 0.58880700 0.58880700 0.91119300 1.0 Cd Cd98 1 0.91119300 0.58880700 0.91119300 1.0 Cd Cd99 1 0.58880700 0.91119300 0.91119300 1.0 Cd Cd100 1 0.76420300 0.06661000 0.40498400 1.0 Cd Cd101 1 0.76420300 0.76420300 0.40498400 1.0 Cd Cd102 1 0.06661000 0.76420300 0.40498400 1.0 Cd Cd103 1 0.76420300 0.40498400 0.06661000 1.0 Cd Cd104 1 0.06661000 0.40498400 0.76420300 1.0 Cd Cd105 1 0.76420300 0.40498400 0.76420300 1.0 Cd Cd106 1 0.40498400 0.76420300 0.76420300 1.0 Cd Cd107 1 0.40498400 0.06661000 0.76420300 1.0 Cd Cd108 1 0.40498400 0.76420300 0.06661000 1.0 Cd Cd109 1 0.06661000 0.76420300 0.76420300 1.0 Cd Cd110 1 0.76420300 0.76420300 0.06661000 1.0 Cd Cd111 1 0.76420300 0.06661000 0.76420300 1.0