# generated using pymatgen data_La13Cd58 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 16.14375215 _cell_length_b 16.14375246 _cell_length_c 15.76529702 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999934 _symmetry_Int_Tables_number 1 _chemical_formula_structural La13Cd58 _chemical_formula_sum 'La26 Cd116' _cell_volume 3558.29346554 _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 La La0 1 0.41128727 0.20564363 0.55182631 1.0 La La1 1 0.87225489 0.74450977 0.25000000 1.0 La La2 1 0.20564363 0.41128727 0.05182631 1.0 La La3 1 0.08457477 0.54228739 0.75000000 1.0 La La4 1 0.79435637 0.58871273 0.94817369 1.0 La La5 1 0.79435637 0.20564363 0.55182631 1.0 La La6 1 0.91542523 0.45771261 0.25000000 1.0 La La7 1 0.79435637 0.20564363 0.94817369 1.0 La La8 1 0.79435637 0.58871273 0.55182631 1.0 La La9 1 0.45771261 0.91542523 0.75000000 1.0 La La10 1 0.12774511 0.87225489 0.75000000 1.0 La La11 1 0.87225489 0.12774511 0.25000000 1.0 La La12 1 0.58871273 0.79435637 0.05182631 1.0 La La13 1 0.58871273 0.79435637 0.44817369 1.0 La La14 1 0.20564363 0.79435637 0.44817369 1.0 La La15 1 0.00000000 0.00000000 0.00000000 1.0 La La16 1 0.45771261 0.54228739 0.75000000 1.0 La La17 1 0.54228739 0.08457477 0.25000000 1.0 La La18 1 0.12774511 0.25549023 0.75000000 1.0 La La19 1 0.74450977 0.87225489 0.75000000 1.0 La La20 1 0.20564363 0.41128727 0.44817369 1.0 La La21 1 0.41128727 0.20564363 0.94817369 1.0 La La22 1 0.00000000 0.00000000 0.50000000 1.0 La La23 1 0.25549023 0.12774511 0.25000000 1.0 La La24 1 0.20564363 0.79435637 0.05182631 1.0 La La25 1 0.54228739 0.45771261 0.25000000 1.0 Cd Cd26 1 0.90580569 0.09419431 0.65615513 1.0 Cd Cd27 1 0.00000000 0.19985012 0.00000000 1.0 Cd Cd28 1 0.63479533 0.96418540 0.60277664 1.0 Cd Cd29 1 0.36520467 0.32939007 0.39722336 1.0 Cd Cd30 1 0.67060993 0.63479533 0.10277664 1.0 Cd Cd31 1 0.60052746 0.39947254 0.05306267 1.0 Cd Cd32 1 0.63479533 0.67060993 0.89722336 1.0 Cd Cd33 1 0.96418540 0.63479533 0.10277664 1.0 Cd Cd34 1 0.20105492 0.60052746 0.94693733 1.0 Cd Cd35 1 0.09419431 0.90580569 0.34384487 1.0 Cd Cd36 1 0.56249319 0.12498638 0.64349467 1.0 Cd Cd37 1 0.81161137 0.90580569 0.34384487 1.0 Cd Cd38 1 0.73160095 0.26839905 0.75000000 1.0 Cd Cd39 1 0.43750681 0.87501362 0.35650533 1.0 Cd Cd40 1 0.32939007 0.36520467 0.89722336 1.0 Cd Cd41 1 0.03581460 0.67060993 0.89722336 1.0 Cd Cd42 1 0.52985092 0.76492546 0.84144572 1.0 Cd Cd43 1 0.80014988 0.80014988 0.00000000 1.0 Cd Cd44 1 0.36520467 0.03581460 0.39722336 1.0 Cd Cd45 1 0.00000000 0.19985012 0.50000000 1.0 Cd Cd46 1 0.91737816 0.63751943 0.75000000 1.0 Cd Cd47 1 0.19985012 0.19985012 0.50000000 1.0 Cd Cd48 1 0.67060993 0.03581460 0.10277664 1.0 Cd Cd49 1 0.60052746 0.39947254 0.44693733 1.0 Cd Cd50 1 0.76492546 0.52985092 0.34144572 1.0 Cd Cd51 1 0.76492546 0.52985092 0.15855428 1.0 Cd Cd52 1 0.96418540 0.32939007 0.10277664 1.0 Cd Cd53 1 0.66666700 0.33333300 0.59420500 1.0 Cd Cd54 1 0.27985872 0.91737816 0.25000000 1.0 Cd Cd55 1 0.47014908 0.23507454 0.34144572 1.0 Cd Cd56 1 0.03581460 0.36520467 0.60277664 1.0 Cd Cd57 1 0.33333300 0.66666700 0.75000000 1.0 Cd Cd58 1 0.72014128 0.08262184 0.75000000 1.0 Cd Cd59 1 0.03581460 0.36520467 0.89722336 1.0 Cd Cd60 1 0.80014988 0.00000000 0.50000000 1.0 Cd Cd61 1 0.60052746 0.20105492 0.44693733 1.0 Cd Cd62 1 0.67060993 0.03581460 0.39722336 1.0 Cd Cd63 1 0.36248057 0.08262184 0.75000000 1.0 Cd Cd64 1 0.91737816 0.27985872 0.75000000 1.0 Cd Cd65 1 1.00000000 0.80014988 0.00000000 1.0 Cd Cd66 1 0.43750681 0.56249319 0.14349467 1.0 Cd Cd67 1 0.12498638 0.56249319 0.35650533 1.0 Cd Cd68 1 0.50000000 0.00000000 0.50000000 1.0 Cd Cd69 1 0.90580569 0.81161137 0.84384487 1.0 Cd Cd70 1 0.09419431 0.18838863 0.15615513 1.0 Cd Cd71 1 0.03581460 0.67060993 0.60277664 1.0 Cd Cd72 1 0.32939007 0.36520467 0.60277664 1.0 Cd Cd73 1 0.56249319 0.12498638 0.85650533 1.0 Cd Cd74 1 0.20105492 0.60052746 0.55306267 1.0 Cd Cd75 1 0.63479533 0.67060993 0.60277664 1.0 Cd Cd76 1 0.43750681 0.56249319 0.35650533 1.0 Cd Cd77 1 0.00000000 0.00000000 0.25000000 1.0 Cd Cd78 1 0.60052746 0.20105492 0.05306267 1.0 Cd Cd79 1 0.79894508 0.39947254 0.44693733 1.0 Cd Cd80 1 0.73160095 0.46320190 0.75000000 1.0 Cd Cd81 1 0.39947254 0.79894508 0.94693733 1.0 Cd Cd82 1 0.66666700 0.33333300 0.90579500 1.0 Cd Cd83 1 0.23507454 0.47014908 0.84144572 1.0 Cd Cd84 1 0.76492546 0.23507454 0.15855428 1.0 Cd Cd85 1 0.27985872 0.36248057 0.25000000 1.0 Cd Cd86 1 0.39947254 0.60052746 0.55306267 1.0 Cd Cd87 1 0.36520467 0.03581460 0.10277664 1.0 Cd Cd88 1 0.76492546 0.23507454 0.34144572 1.0 Cd Cd89 1 0.81161137 0.90580569 0.15615513 1.0 Cd Cd90 1 0.32939007 0.96418540 0.89722336 1.0 Cd Cd91 1 0.87501362 0.43750681 0.85650533 1.0 Cd Cd92 1 0.90580569 0.81161137 0.65615513 1.0 Cd Cd93 1 0.12498638 0.56249319 0.14349467 1.0 Cd Cd94 1 0.96418540 0.32939007 0.39722336 1.0 Cd Cd95 1 0.63751943 0.72014128 0.25000000 1.0 Cd Cd96 1 0.56249319 0.43750681 0.85650533 1.0 Cd Cd97 1 0.47014908 0.23507454 0.15855428 1.0 Cd Cd98 1 0.80014988 0.80014988 0.50000000 1.0 Cd Cd99 1 0.00000000 0.00000000 0.75000000 1.0 Cd Cd100 1 0.18838863 0.09419431 0.65615513 1.0 Cd Cd101 1 0.19985012 0.19985012 0.00000000 1.0 Cd Cd102 1 0.19985012 0.00000000 0.50000000 1.0 Cd Cd103 1 0.08262184 0.36248057 0.25000000 1.0 Cd Cd104 1 0.67060993 0.63479533 0.39722336 1.0 Cd Cd105 1 0.52985092 0.76492546 0.65855428 1.0 Cd Cd106 1 0.79894508 0.39947254 0.05306267 1.0 Cd Cd107 1 0.36520467 0.32939007 0.10277664 1.0 Cd Cd108 1 0.23507454 0.76492546 0.84144572 1.0 Cd Cd109 1 0.66666700 0.33333300 0.25000000 1.0 Cd Cd110 1 0.43750681 0.87501362 0.14349467 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 0.23507454 0.76492546 0.65855428 1.0 Cd Cd114 1 0.33333300 0.66666700 0.40579500 1.0 Cd Cd115 1 0.19985012 0.00000000 0.00000000 1.0 Cd Cd116 1 0.08262184 0.72014128 0.25000000 1.0 Cd Cd117 1 1.00000000 0.80014988 0.50000000 1.0 Cd Cd118 1 0.63479533 0.96418540 0.89722336 1.0 Cd Cd119 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd120 1 0.18838863 0.09419431 0.84384487 1.0 Cd Cd121 1 0.53679810 0.26839905 0.75000000 1.0 Cd Cd122 1 0.09419431 0.90580569 0.15615513 1.0 Cd Cd123 1 0.90580569 0.09419431 0.84384487 1.0 Cd Cd124 1 0.56249319 0.43750681 0.64349467 1.0 Cd Cd125 1 0.36248057 0.27985872 0.75000000 1.0 Cd Cd126 1 0.26839905 0.73160095 0.25000000 1.0 Cd Cd127 1 0.96418540 0.63479533 0.39722336 1.0 Cd Cd128 1 0.33333300 0.66666700 0.09420500 1.0 Cd Cd129 1 0.26839905 0.53679810 0.25000000 1.0 Cd Cd130 1 0.80014988 0.00000000 0.00000000 1.0 Cd Cd131 1 0.63751943 0.91737816 0.25000000 1.0 Cd Cd132 1 0.50000000 0.00000000 0.00000000 1.0 Cd Cd133 1 0.87501362 0.43750681 0.64349467 1.0 Cd Cd134 1 0.32939007 0.96418540 0.60277664 1.0 Cd Cd135 1 0.00000000 0.50000000 0.00000000 1.0 Cd Cd136 1 0.09419431 0.18838863 0.34384487 1.0 Cd Cd137 1 0.39947254 0.60052746 0.94693733 1.0 Cd Cd138 1 0.23507454 0.47014908 0.65855428 1.0 Cd Cd139 1 0.72014128 0.63751943 0.75000000 1.0 Cd Cd140 1 0.39947254 0.79894508 0.55306267 1.0 Cd Cd141 1 0.46320190 0.73160095 0.25000000 1.0