# generated using pymatgen data_Ce13Zn58 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 14.56028337 _cell_length_b 14.56028348 _cell_length_c 14.00747863 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999972 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce13Zn58 _chemical_formula_sum 'Ce26 Zn116' _cell_volume 2571.75894699 _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 Ce Ce0 1 0.79489066 0.58978133 0.94865034 1.0 Ce Ce1 1 0.41021867 0.20510934 0.55134966 1.0 Ce Ce2 1 0.08258815 0.54129408 0.75000000 1.0 Ce Ce3 1 0.20510934 0.79489066 0.44865034 1.0 Ce Ce4 1 0.20510934 0.41021867 0.44865034 1.0 Ce Ce5 1 0.87257003 0.12742997 0.25000000 1.0 Ce Ce6 1 0.20510934 0.79489066 0.05134966 1.0 Ce Ce7 1 0.54129408 0.45870592 0.25000000 1.0 Ce Ce8 1 0.12742997 0.87257003 0.75000000 1.0 Ce Ce9 1 0.12742997 0.25485994 0.75000000 1.0 Ce Ce10 1 0.41021867 0.20510934 0.94865034 1.0 Ce Ce11 1 0.79489066 0.58978133 0.55134966 1.0 Ce Ce12 1 0.87257003 0.74514006 0.25000000 1.0 Ce Ce13 1 0.79489066 0.20510934 0.55134966 1.0 Ce Ce14 1 0.58978133 0.79489066 0.05134966 1.0 Ce Ce15 1 0.91741185 0.45870592 0.25000000 1.0 Ce Ce16 1 0.25485994 0.12742997 0.25000000 1.0 Ce Ce17 1 0.00000000 0.00000000 0.50000000 1.0 Ce Ce18 1 0.45870592 0.91741185 0.75000000 1.0 Ce Ce19 1 0.20510934 0.41021867 0.05134966 1.0 Ce Ce20 1 0.74514006 0.87257003 0.75000000 1.0 Ce Ce21 1 0.54129408 0.08258815 0.25000000 1.0 Ce Ce22 1 0.45870592 0.54129408 0.75000000 1.0 Ce Ce23 1 0.00000000 0.00000000 0.00000000 1.0 Ce Ce24 1 0.58978133 0.79489066 0.44865034 1.0 Ce Ce25 1 0.79489066 0.20510934 0.94865034 1.0 Zn Zn26 1 0.47406084 0.23703042 0.15785437 1.0 Zn Zn27 1 0.96499750 0.63441982 0.39738714 1.0 Zn Zn28 1 0.20148178 0.00000000 0.00000000 1.0 Zn Zn29 1 0.73085821 0.46171642 0.75000000 1.0 Zn Zn30 1 0.33333300 0.66666700 0.09734421 1.0 Zn Zn31 1 0.90532753 0.09467247 0.84373860 1.0 Zn Zn32 1 0.71885460 0.63446916 0.75000000 1.0 Zn Zn33 1 0.03500250 0.36558018 0.89738714 1.0 Zn Zn34 1 0.76296958 0.23703042 0.34214563 1.0 Zn Zn35 1 0.36553084 0.28114540 0.75000000 1.0 Zn Zn36 1 0.12872674 0.56436337 0.14283429 1.0 Zn Zn37 1 0.90532753 0.81065506 0.84373860 1.0 Zn Zn38 1 0.66942232 0.63441982 0.39738714 1.0 Zn Zn39 1 0.96499750 0.33057768 0.39738714 1.0 Zn Zn40 1 0.03500250 0.66942232 0.60261286 1.0 Zn Zn41 1 0.66666700 0.33333300 0.59734421 1.0 Zn Zn42 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn43 1 0.63441982 0.66942232 0.60261286 1.0 Zn Zn44 1 0.00000000 0.79851822 0.50000000 1.0 Zn Zn45 1 0.39832092 0.79664184 0.94893434 1.0 Zn Zn46 1 0.56436337 0.43563663 0.85716571 1.0 Zn Zn47 1 0.91561455 0.63446916 0.75000000 1.0 Zn Zn48 1 0.09467247 0.18934494 0.34373860 1.0 Zn Zn49 1 0.20148178 0.20148178 0.00000000 1.0 Zn Zn50 1 0.63446916 0.71885460 0.25000000 1.0 Zn Zn51 1 0.26914179 0.73085821 0.25000000 1.0 Zn Zn52 1 0.00000000 0.79851822 0.00000000 1.0 Zn Zn53 1 1.00000000 0.20148178 0.00000000 1.0 Zn Zn54 1 1.00000000 0.20148178 0.50000000 1.0 Zn Zn55 1 0.63441982 0.96499750 0.60261286 1.0 Zn Zn56 1 0.79851822 0.79851822 0.00000000 1.0 Zn Zn57 1 0.66942232 0.03500250 0.10261286 1.0 Zn Zn58 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn59 1 0.23703042 0.47406084 0.65785437 1.0 Zn Zn60 1 0.33333300 0.66666700 0.75000000 1.0 Zn Zn61 1 0.09467247 0.18934494 0.15626140 1.0 Zn Zn62 1 0.12872674 0.56436337 0.35716571 1.0 Zn Zn63 1 0.23703042 0.47406084 0.84214563 1.0 Zn Zn64 1 0.39832092 0.79664184 0.55106566 1.0 Zn Zn65 1 0.79851822 0.79851822 0.50000000 1.0 Zn Zn66 1 0.46171642 0.73085821 0.25000000 1.0 Zn Zn67 1 0.36558018 0.03500250 0.39738714 1.0 Zn Zn68 1 0.43563663 0.87127326 0.35716571 1.0 Zn Zn69 1 0.71885460 0.08438545 0.75000000 1.0 Zn Zn70 1 0.09467247 0.90532753 0.15626140 1.0 Zn Zn71 1 0.09467247 0.90532753 0.34373860 1.0 Zn Zn72 1 0.63441982 0.66942232 0.89738714 1.0 Zn Zn73 1 0.20148178 0.20148178 0.50000000 1.0 Zn Zn74 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn75 1 0.43563663 0.56436337 0.35716571 1.0 Zn Zn76 1 0.66666700 0.33333300 0.90265579 1.0 Zn Zn77 1 0.60167908 0.39832092 0.05106566 1.0 Zn Zn78 1 0.90532753 0.81065506 0.65626140 1.0 Zn Zn79 1 0.03500250 0.36558018 0.60261286 1.0 Zn Zn80 1 0.73085821 0.26914179 0.75000000 1.0 Zn Zn81 1 0.90532753 0.09467247 0.65626140 1.0 Zn Zn82 1 0.96499750 0.63441982 0.10261286 1.0 Zn Zn83 1 0.08438545 0.36553084 0.25000000 1.0 Zn Zn84 1 0.60167908 0.20335816 0.44893434 1.0 Zn Zn85 1 0.20335816 0.60167908 0.94893434 1.0 Zn Zn86 1 0.76296958 0.52593916 0.15785437 1.0 Zn Zn87 1 0.56436337 0.43563663 0.64283429 1.0 Zn Zn88 1 0.79851822 0.00000000 0.50000000 1.0 Zn Zn89 1 0.96499750 0.33057768 0.10261286 1.0 Zn Zn90 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn91 1 0.36558018 0.33057768 0.39738714 1.0 Zn Zn92 1 0.66942232 0.63441982 0.10261286 1.0 Zn Zn93 1 0.33333300 0.66666700 0.40265579 1.0 Zn Zn94 1 0.00000000 0.00000000 0.25000000 1.0 Zn Zn95 1 0.76296958 0.52593916 0.34214563 1.0 Zn Zn96 1 0.81065506 0.90532753 0.15626140 1.0 Zn Zn97 1 0.91561455 0.28114540 0.75000000 1.0 Zn Zn98 1 0.56436337 0.12872674 0.64283429 1.0 Zn Zn99 1 0.33057768 0.96499750 0.89738714 1.0 Zn Zn100 1 0.43563663 0.56436337 0.14283429 1.0 Zn Zn101 1 0.03500250 0.66942232 0.89738714 1.0 Zn Zn102 1 0.66942232 0.03500250 0.39738714 1.0 Zn Zn103 1 0.60167908 0.39832092 0.44893434 1.0 Zn Zn104 1 0.79664184 0.39832092 0.44893434 1.0 Zn Zn105 1 0.87127326 0.43563663 0.85716571 1.0 Zn Zn106 1 0.36553084 0.08438545 0.75000000 1.0 Zn Zn107 1 0.33057768 0.36558018 0.89738714 1.0 Zn Zn108 1 0.23703042 0.76296958 0.65785437 1.0 Zn Zn109 1 0.08438545 0.71885460 0.25000000 1.0 Zn Zn110 1 0.52593916 0.76296958 0.84214563 1.0 Zn Zn111 1 0.18934494 0.09467247 0.84373860 1.0 Zn Zn112 1 0.81065506 0.90532753 0.34373860 1.0 Zn Zn113 1 0.66666700 0.33333300 0.25000000 1.0 Zn Zn114 1 0.39832092 0.60167908 0.94893434 1.0 Zn Zn115 1 0.00000000 0.00000000 0.75000000 1.0 Zn Zn116 1 0.20335816 0.60167908 0.55106566 1.0 Zn Zn117 1 0.39832092 0.60167908 0.55106566 1.0 Zn Zn118 1 0.18934494 0.09467247 0.65626140 1.0 Zn Zn119 1 0.52593916 0.76296958 0.65785437 1.0 Zn Zn120 1 0.76296958 0.23703042 0.15785437 1.0 Zn Zn121 1 0.50000000 0.50000000 0.50000000 1.0 Zn Zn122 1 0.79664184 0.39832092 0.05106566 1.0 Zn Zn123 1 0.23703042 0.76296958 0.84214563 1.0 Zn Zn124 1 0.63446916 0.91561455 0.25000000 1.0 Zn Zn125 1 0.33057768 0.36558018 0.60261286 1.0 Zn Zn126 1 0.60167908 0.20335816 0.05106566 1.0 Zn Zn127 1 0.87127326 0.43563663 0.64283429 1.0 Zn Zn128 1 0.20148178 0.00000000 0.50000000 1.0 Zn Zn129 1 0.36558018 0.03500250 0.10261286 1.0 Zn Zn130 1 0.33057768 0.96499750 0.60261286 1.0 Zn Zn131 1 0.56436337 0.12872674 0.85716571 1.0 Zn Zn132 1 0.28114540 0.91561455 0.25000000 1.0 Zn Zn133 1 0.28114540 0.36553084 0.25000000 1.0 Zn Zn134 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn135 1 0.47406084 0.23703042 0.34214563 1.0 Zn Zn136 1 0.63441982 0.96499750 0.89738714 1.0 Zn Zn137 1 0.79851822 0.00000000 0.00000000 1.0 Zn Zn138 1 0.36558018 0.33057768 0.10261286 1.0 Zn Zn139 1 0.26914179 0.53828358 0.25000000 1.0 Zn Zn140 1 0.43563663 0.87127326 0.14283429 1.0 Zn Zn141 1 0.53828358 0.26914179 0.75000000 1.0