# generated using pymatgen data_Ca20Zn9CdSn2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.87003962 _cell_length_b 7.87003962 _cell_length_c 15.53903948 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca20Zn9CdSn2 _chemical_formula_sum 'Ca20 Zn9 Cd1 Sn2' _cell_volume 962.44962527 _cell_formula_units_Z 1 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 Ca Ca0 1 0.67751853 0.16912249 0.10573157 1.0 Ca Ca1 1 0.17601277 0.67401744 0.60434060 1.0 Ca Ca2 1 0.32248147 0.83087751 0.10573157 1.0 Ca Ca3 1 0.82398723 0.32598256 0.60434060 1.0 Ca Ca4 1 0.83087751 0.67751853 0.10573157 1.0 Ca Ca5 1 0.32598256 0.17601277 0.60434060 1.0 Ca Ca6 1 0.16912249 0.32248147 0.10573157 1.0 Ca Ca7 1 0.67401744 0.82398723 0.60434060 1.0 Ca Ca8 1 0.83087751 0.32248147 0.89426843 1.0 Ca Ca9 1 0.32598256 0.82398723 0.39565940 1.0 Ca Ca10 1 0.16912249 0.67751853 0.89426843 1.0 Ca Ca11 1 0.67401744 0.17601277 0.39565940 1.0 Ca Ca12 1 0.67751853 0.83087751 0.89426843 1.0 Ca Ca13 1 0.17601277 0.32598256 0.39565940 1.0 Ca Ca14 1 0.32248147 0.16912249 0.89426843 1.0 Ca Ca15 1 0.82398723 0.67401744 0.39565940 1.0 Ca Ca16 1 0.50000000 0.50000000 0.75120688 1.0 Ca Ca17 1 0.00000000 0.00000000 0.25559829 1.0 Ca Ca18 1 0.00000000 0.00000000 0.74440171 1.0 Ca Ca19 1 0.50000000 0.50000000 0.24879312 1.0 Zn Zn20 1 0.61143606 0.11140025 0.74926734 1.0 Zn Zn21 1 0.11140025 0.61143606 0.25073266 1.0 Zn Zn22 1 0.88859975 0.38856394 0.25073266 1.0 Zn Zn23 1 0.38856394 0.88859975 0.74926734 1.0 Zn Zn24 1 0.88859975 0.61143606 0.74926734 1.0 Zn Zn25 1 0.38856394 0.11140025 0.25073266 1.0 Zn Zn26 1 0.11140025 0.38856394 0.74926734 1.0 Zn Zn27 1 0.61143606 0.88859975 0.25073266 1.0 Zn Zn28 1 0.00000000 0.00000000 0.00000000 1.0 Cd Cd29 1 0.50000000 0.50000000 0.00000000 1.0 Sn Sn30 1 0.50000000 0.50000000 0.50000000 1.0 Sn Sn31 1 0.00000000 0.00000000 0.50000000 1.0