# generated using pymatgen data_Er11Cd45 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.34871294 _cell_length_b 15.34871294 _cell_length_c 15.34871294 _cell_angle_alpha 60.00000000 _cell_angle_beta 60.00000000 _cell_angle_gamma 60.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er11Cd45 _chemical_formula_sum 'Er22 Cd90' _cell_volume 2556.82434693 _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 Er Er0 1 0.00000000 0.00000000 0.00000000 1.0 Er Er1 1 0.01382200 0.33398500 0.63837100 1.0 Er Er2 1 0.01382200 0.01382200 0.63837100 1.0 Er Er3 1 0.33398500 0.01382200 0.63837100 1.0 Er Er4 1 0.01382200 0.63837100 0.33398500 1.0 Er Er5 1 0.33398500 0.63837100 0.01382200 1.0 Er Er6 1 0.01382200 0.63837100 0.01382200 1.0 Er Er7 1 0.63837100 0.01382200 0.01382200 1.0 Er Er8 1 0.63837100 0.33398500 0.01382200 1.0 Er Er9 1 0.63837100 0.01382200 0.33398500 1.0 Er Er10 1 0.33398500 0.01382200 0.01382200 1.0 Er Er11 1 0.01382200 0.01382200 0.33398500 1.0 Er Er12 1 0.01382200 0.33398500 0.01382200 1.0 Er Er13 1 0.25000000 0.25000000 0.25000000 1.0 Er Er14 1 0.40625800 0.40625800 0.78122700 1.0 Er Er15 1 0.40625800 0.78122700 0.40625800 1.0 Er Er16 1 0.78122700 0.40625800 0.40625800 1.0 Er Er17 1 0.40625800 0.40625800 0.40625800 1.0 Er Er18 1 0.66187800 0.66187800 0.01436500 1.0 Er Er19 1 0.66187800 0.01436500 0.66187800 1.0 Er Er20 1 0.01436500 0.66187800 0.66187800 1.0 Er Er21 1 0.66187800 0.66187800 0.66187800 1.0 Cd Cd22 1 0.08319900 0.08319900 0.75040200 1.0 Cd Cd23 1 0.08319900 0.75040200 0.08319900 1.0 Cd Cd24 1 0.75040200 0.08319900 0.08319900 1.0 Cd Cd25 1 0.08319900 0.08319900 0.08319900 1.0 Cd Cd26 1 0.91325000 0.91325000 0.26025100 1.0 Cd Cd27 1 0.91325000 0.26025100 0.91325000 1.0 Cd Cd28 1 0.26025100 0.91325000 0.91325000 1.0 Cd Cd29 1 0.91325000 0.91325000 0.91325000 1.0 Cd Cd30 1 0.15634600 0.15634600 0.84365400 1.0 Cd Cd31 1 0.84365400 0.15634600 0.84365400 1.0 Cd Cd32 1 0.15634600 0.84365400 0.84365400 1.0 Cd Cd33 1 0.84365400 0.84365400 0.15634600 1.0 Cd Cd34 1 0.15634600 0.84365400 0.15634600 1.0 Cd Cd35 1 0.84365400 0.15634600 0.15634600 1.0 Cd Cd36 1 0.39057200 0.20121700 0.01764000 1.0 Cd Cd37 1 0.39057200 0.39057200 0.01764000 1.0 Cd Cd38 1 0.20121700 0.39057200 0.01764000 1.0 Cd Cd39 1 0.39057200 0.01764000 0.20121700 1.0 Cd Cd40 1 0.20121700 0.01764000 0.39057200 1.0 Cd Cd41 1 0.39057200 0.01764000 0.39057200 1.0 Cd Cd42 1 0.01764000 0.39057200 0.39057200 1.0 Cd Cd43 1 0.01764000 0.20121700 0.39057200 1.0 Cd Cd44 1 0.01764000 0.39057200 0.20121700 1.0 Cd Cd45 1 0.20121700 0.39057200 0.39057200 1.0 Cd Cd46 1 0.39057200 0.39057200 0.20121700 1.0 Cd Cd47 1 0.39057200 0.20121700 0.39057200 1.0 Cd Cd48 1 0.16358000 0.16358000 0.50926000 1.0 Cd Cd49 1 0.16358000 0.50926000 0.16358000 1.0 Cd Cd50 1 0.50926000 0.16358000 0.16358000 1.0 Cd Cd51 1 0.16358000 0.16358000 0.16358000 1.0 Cd Cd52 1 0.26323200 0.61190900 0.86162800 1.0 Cd Cd53 1 0.26323200 0.26323200 0.86162800 1.0 Cd Cd54 1 0.61190900 0.26323200 0.86162800 1.0 Cd Cd55 1 0.26323200 0.86162800 0.61190900 1.0 Cd Cd56 1 0.61190900 0.86162800 0.26323200 1.0 Cd Cd57 1 0.26323200 0.86162800 0.26323200 1.0 Cd Cd58 1 0.86162800 0.26323200 0.26323200 1.0 Cd Cd59 1 0.86162800 0.61190900 0.26323200 1.0 Cd Cd60 1 0.86162800 0.26323200 0.61190900 1.0 Cd Cd61 1 0.61190900 0.26323200 0.26323200 1.0 Cd Cd62 1 0.26323200 0.26323200 0.61190900 1.0 Cd Cd63 1 0.26323200 0.61190900 0.26323200 1.0 Cd Cd64 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd65 1 0.64043100 0.45044000 0.26869800 1.0 Cd Cd66 1 0.64043100 0.64043100 0.26869800 1.0 Cd Cd67 1 0.45044000 0.64043100 0.26869800 1.0 Cd Cd68 1 0.64043100 0.26869800 0.45044000 1.0 Cd Cd69 1 0.45044000 0.26869800 0.64043100 1.0 Cd Cd70 1 0.64043100 0.26869800 0.64043100 1.0 Cd Cd71 1 0.26869800 0.64043100 0.64043100 1.0 Cd Cd72 1 0.26869800 0.45044000 0.64043100 1.0 Cd Cd73 1 0.26869800 0.64043100 0.45044000 1.0 Cd Cd74 1 0.45044000 0.64043100 0.64043100 1.0 Cd Cd75 1 0.64043100 0.64043100 0.45044000 1.0 Cd Cd76 1 0.64043100 0.45044000 0.64043100 1.0 Cd Cd77 1 0.51239000 0.83377900 0.14144000 1.0 Cd Cd78 1 0.51239000 0.51239000 0.14144000 1.0 Cd Cd79 1 0.83377900 0.51239000 0.14144000 1.0 Cd Cd80 1 0.51239000 0.14144000 0.83377900 1.0 Cd Cd81 1 0.83377900 0.14144000 0.51239000 1.0 Cd Cd82 1 0.51239000 0.14144000 0.51239000 1.0 Cd Cd83 1 0.14144000 0.51239000 0.51239000 1.0 Cd Cd84 1 0.14144000 0.83377900 0.51239000 1.0 Cd Cd85 1 0.14144000 0.51239000 0.83377900 1.0 Cd Cd86 1 0.83377900 0.51239000 0.51239000 1.0 Cd Cd87 1 0.51239000 0.51239000 0.83377900 1.0 Cd Cd88 1 0.51239000 0.83377900 0.51239000 1.0 Cd Cd89 1 0.75000000 0.75000000 0.75000000 1.0 Cd Cd90 1 0.83004800 0.83004800 0.50985500 1.0 Cd Cd91 1 0.83004800 0.50985500 0.83004800 1.0 Cd Cd92 1 0.50985500 0.83004800 0.83004800 1.0 Cd Cd93 1 0.83004800 0.83004800 0.83004800 1.0 Cd Cd94 1 0.91088200 0.91088200 0.58911800 1.0 Cd Cd95 1 0.58911800 0.91088200 0.58911800 1.0 Cd Cd96 1 0.91088200 0.58911800 0.58911800 1.0 Cd Cd97 1 0.58911800 0.58911800 0.91088200 1.0 Cd Cd98 1 0.91088200 0.58911800 0.91088200 1.0 Cd Cd99 1 0.58911800 0.91088200 0.91088200 1.0 Cd Cd100 1 0.76388000 0.06736800 0.40487100 1.0 Cd Cd101 1 0.76388000 0.76388000 0.40487100 1.0 Cd Cd102 1 0.06736800 0.76388000 0.40487100 1.0 Cd Cd103 1 0.76388000 0.40487100 0.06736800 1.0 Cd Cd104 1 0.06736800 0.40487100 0.76388000 1.0 Cd Cd105 1 0.76388000 0.40487100 0.76388000 1.0 Cd Cd106 1 0.40487100 0.76388000 0.76388000 1.0 Cd Cd107 1 0.40487100 0.06736800 0.76388000 1.0 Cd Cd108 1 0.40487100 0.76388000 0.06736800 1.0 Cd Cd109 1 0.06736800 0.76388000 0.76388000 1.0 Cd Cd110 1 0.76388000 0.76388000 0.06736800 1.0 Cd Cd111 1 0.76388000 0.06736800 0.76388000 1.0