# generated using pymatgen data_Sm13Cd58 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.90041807 _cell_length_b 15.90041807 _cell_length_c 15.61204500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000029 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm13Cd58 _chemical_formula_sum 'Sm26 Cd116' _cell_volume 3418.27903670 _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 Sm Sm0 1 0.41138100 0.20569000 0.55254400 1.0 Sm Sm1 1 0.87169100 0.74338100 0.25000000 1.0 Sm Sm2 1 0.20569000 0.41138100 0.05254400 1.0 Sm Sm3 1 0.08739800 0.54369900 0.75000000 1.0 Sm Sm4 1 0.79431000 0.58861900 0.94745600 1.0 Sm Sm5 1 0.79431000 0.20569000 0.55254400 1.0 Sm Sm6 1 0.91260200 0.45630100 0.25000000 1.0 Sm Sm7 1 0.79431000 0.20569000 0.94745600 1.0 Sm Sm8 1 0.79431000 0.58861900 0.55254400 1.0 Sm Sm9 1 0.45630100 0.91260200 0.75000000 1.0 Sm Sm10 1 0.12830900 0.87169100 0.75000000 1.0 Sm Sm11 1 0.87169100 0.12830900 0.25000000 1.0 Sm Sm12 1 0.58861900 0.79431000 0.05254400 1.0 Sm Sm13 1 0.58861900 0.79431000 0.44745600 1.0 Sm Sm14 1 0.20569000 0.79431000 0.44745600 1.0 Sm Sm15 1 0.00000000 0.00000000 0.00000000 1.0 Sm Sm16 1 0.45630100 0.54369900 0.75000000 1.0 Sm Sm17 1 0.54369900 0.08739800 0.25000000 1.0 Sm Sm18 1 0.12830900 0.25661900 0.75000000 1.0 Sm Sm19 1 0.74338100 0.87169100 0.75000000 1.0 Sm Sm20 1 0.20569000 0.41138100 0.44745600 1.0 Sm Sm21 1 0.41138100 0.20569000 0.94745600 1.0 Sm Sm22 1 0.00000000 0.00000000 0.50000000 1.0 Sm Sm23 1 0.25661900 0.12830900 0.25000000 1.0 Sm Sm24 1 0.20569000 0.79431000 0.05254400 1.0 Sm Sm25 1 0.54369900 0.45630100 0.25000000 1.0 Cd Cd26 1 0.90761200 0.09238800 0.65572300 1.0 Cd Cd27 1 0.00000000 0.19835500 0.00000000 1.0 Cd Cd28 1 0.63525700 0.96402400 0.60218600 1.0 Cd Cd29 1 0.36474300 0.32876600 0.39781400 1.0 Cd Cd30 1 0.67123400 0.63525700 0.10218600 1.0 Cd Cd31 1 0.60027300 0.39972700 0.05192700 1.0 Cd Cd32 1 0.63525700 0.67123400 0.89781400 1.0 Cd Cd33 1 0.96402400 0.63525700 0.10218600 1.0 Cd Cd34 1 0.20054500 0.60027300 0.94807300 1.0 Cd Cd35 1 0.09238800 0.90761200 0.34427700 1.0 Cd Cd36 1 0.56063700 0.12127500 0.64620400 1.0 Cd Cd37 1 0.81522400 0.90761200 0.34427700 1.0 Cd Cd38 1 0.73301100 0.26698900 0.75000000 1.0 Cd Cd39 1 0.43936300 0.87872500 0.35379600 1.0 Cd Cd40 1 0.32876600 0.36474300 0.89781400 1.0 Cd Cd41 1 0.03597600 0.67123400 0.89781400 1.0 Cd Cd42 1 0.53108200 0.76554100 0.84153200 1.0 Cd Cd43 1 0.80164500 0.80164500 0.00000000 1.0 Cd Cd44 1 0.36474300 0.03597600 0.39781400 1.0 Cd Cd45 1 0.00000000 0.19835500 0.50000000 1.0 Cd Cd46 1 0.91880900 0.64279300 0.75000000 1.0 Cd Cd47 1 0.19835500 0.19835500 0.50000000 1.0 Cd Cd48 1 0.67123400 0.03597600 0.10218600 1.0 Cd Cd49 1 0.60027300 0.39972700 0.44807300 1.0 Cd Cd50 1 0.76554100 0.53108200 0.34153200 1.0 Cd Cd51 1 0.76554100 0.53108200 0.15846800 1.0 Cd Cd52 1 0.96402400 0.32876600 0.10218600 1.0 Cd Cd53 1 0.66666700 0.33333300 0.59568400 1.0 Cd Cd54 1 0.27601600 0.91880900 0.25000000 1.0 Cd Cd55 1 0.46891800 0.23445900 0.34153200 1.0 Cd Cd56 1 0.03597600 0.36474300 0.60218600 1.0 Cd Cd57 1 0.33333300 0.66666700 0.75000000 1.0 Cd Cd58 1 0.72398400 0.08119100 0.75000000 1.0 Cd Cd59 1 0.03597600 0.36474300 0.89781400 1.0 Cd Cd60 1 0.80164500 0.00000000 0.50000000 1.0 Cd Cd61 1 0.60027300 0.20054500 0.44807300 1.0 Cd Cd62 1 0.67123400 0.03597600 0.39781400 1.0 Cd Cd63 1 0.35720700 0.08119100 0.75000000 1.0 Cd Cd64 1 0.91880900 0.27601600 0.75000000 1.0 Cd Cd65 1 0.00000000 0.80164500 0.00000000 1.0 Cd Cd66 1 0.43936300 0.56063700 0.14620400 1.0 Cd Cd67 1 0.12127500 0.56063700 0.35379600 1.0 Cd Cd68 1 0.50000000 0.00000000 0.50000000 1.0 Cd Cd69 1 0.90761200 0.81522400 0.84427700 1.0 Cd Cd70 1 0.09238800 0.18477600 0.15572300 1.0 Cd Cd71 1 0.03597600 0.67123400 0.60218600 1.0 Cd Cd72 1 0.32876600 0.36474300 0.60218600 1.0 Cd Cd73 1 0.56063700 0.12127500 0.85379600 1.0 Cd Cd74 1 0.20054500 0.60027300 0.55192700 1.0 Cd Cd75 1 0.63525700 0.67123400 0.60218600 1.0 Cd Cd76 1 0.43936300 0.56063700 0.35379600 1.0 Cd Cd77 1 0.00000000 0.00000000 0.25000000 1.0 Cd Cd78 1 0.60027300 0.20054500 0.05192700 1.0 Cd Cd79 1 0.79945500 0.39972700 0.44807300 1.0 Cd Cd80 1 0.73301100 0.46602200 0.75000000 1.0 Cd Cd81 1 0.39972700 0.79945500 0.94807300 1.0 Cd Cd82 1 0.66666700 0.33333300 0.90431600 1.0 Cd Cd83 1 0.23445900 0.46891800 0.84153200 1.0 Cd Cd84 1 0.76554100 0.23445900 0.15846800 1.0 Cd Cd85 1 0.27601600 0.35720700 0.25000000 1.0 Cd Cd86 1 0.39972700 0.60027300 0.55192700 1.0 Cd Cd87 1 0.36474300 0.03597600 0.10218600 1.0 Cd Cd88 1 0.76554100 0.23445900 0.34153200 1.0 Cd Cd89 1 0.81522400 0.90761200 0.15572300 1.0 Cd Cd90 1 0.32876600 0.96402400 0.89781400 1.0 Cd Cd91 1 0.87872500 0.43936300 0.85379600 1.0 Cd Cd92 1 0.90761200 0.81522400 0.65572300 1.0 Cd Cd93 1 0.12127500 0.56063700 0.14620400 1.0 Cd Cd94 1 0.96402400 0.32876600 0.39781400 1.0 Cd Cd95 1 0.64279300 0.72398400 0.25000000 1.0 Cd Cd96 1 0.56063700 0.43936300 0.85379600 1.0 Cd Cd97 1 0.46891800 0.23445900 0.15846800 1.0 Cd Cd98 1 0.80164500 0.80164500 0.50000000 1.0 Cd Cd99 1 0.00000000 0.00000000 0.75000000 1.0 Cd Cd100 1 0.18477600 0.09238800 0.65572300 1.0 Cd Cd101 1 0.19835500 0.19835500 0.00000000 1.0 Cd Cd102 1 0.19835500 0.00000000 0.50000000 1.0 Cd Cd103 1 0.08119100 0.35720700 0.25000000 1.0 Cd Cd104 1 0.67123400 0.63525700 0.39781400 1.0 Cd Cd105 1 0.53108200 0.76554100 0.65846800 1.0 Cd Cd106 1 0.79945500 0.39972700 0.05192700 1.0 Cd Cd107 1 0.36474300 0.32876600 0.10218600 1.0 Cd Cd108 1 0.23445900 0.76554100 0.84153200 1.0 Cd Cd109 1 0.66666700 0.33333300 0.25000000 1.0 Cd Cd110 1 0.43936300 0.87872500 0.14620400 1.0 Cd Cd111 1 0.50000000 0.50000000 0.00000000 1.0 Cd Cd112 1 0.00000000 0.50000000 0.50000000 1.0 Cd Cd113 1 0.23445900 0.76554100 0.65846800 1.0 Cd Cd114 1 0.33333300 0.66666700 0.40431600 1.0 Cd Cd115 1 0.19835500 0.00000000 0.00000000 1.0 Cd Cd116 1 0.08119100 0.72398400 0.25000000 1.0 Cd Cd117 1 0.00000000 0.80164500 0.50000000 1.0 Cd Cd118 1 0.63525700 0.96402400 0.89781400 1.0 Cd Cd119 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd120 1 0.18477600 0.09238800 0.84427700 1.0 Cd Cd121 1 0.53397800 0.26698900 0.75000000 1.0 Cd Cd122 1 0.09238800 0.90761200 0.15572300 1.0 Cd Cd123 1 0.90761200 0.09238800 0.84427700 1.0 Cd Cd124 1 0.56063700 0.43936300 0.64620400 1.0 Cd Cd125 1 0.35720700 0.27601600 0.75000000 1.0 Cd Cd126 1 0.26698900 0.73301100 0.25000000 1.0 Cd Cd127 1 0.96402400 0.63525700 0.39781400 1.0 Cd Cd128 1 0.33333300 0.66666700 0.09568400 1.0 Cd Cd129 1 0.26698900 0.53397800 0.25000000 1.0 Cd Cd130 1 0.80164500 0.00000000 0.00000000 1.0 Cd Cd131 1 0.64279300 0.91880900 0.25000000 1.0 Cd Cd132 1 0.50000000 0.00000000 0.00000000 1.0 Cd Cd133 1 0.87872500 0.43936300 0.64620400 1.0 Cd Cd134 1 0.32876600 0.96402400 0.60218600 1.0 Cd Cd135 1 0.00000000 0.50000000 0.00000000 1.0 Cd Cd136 1 0.09238800 0.18477600 0.34427700 1.0 Cd Cd137 1 0.39972700 0.60027300 0.94807300 1.0 Cd Cd138 1 0.23445900 0.46891800 0.65846800 1.0 Cd Cd139 1 0.72398400 0.64279300 0.75000000 1.0 Cd Cd140 1 0.39972700 0.79945500 0.55192700 1.0 Cd Cd141 1 0.46602200 0.73301100 0.25000000 1.0