# generated using pymatgen data_Yb11Mg(CuSi)12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.21184275 _cell_length_b 7.14178963 _cell_length_c 20.53867945 _cell_angle_alpha 90.36183948 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb11Mg(CuSi)12 _chemical_formula_sum 'Yb11 Mg1 Cu12 Si12' _cell_volume 617.79310709 _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 Yb Yb0 1 0.25000000 0.70724398 0.00140209 1.0 Yb Yb1 1 0.75000000 0.28844993 0.99561361 1.0 Yb Yb2 1 0.75000000 0.20898914 0.49766485 1.0 Yb Yb3 1 0.25000000 0.79134215 0.50385880 1.0 Yb Yb4 1 0.25000000 0.79554310 0.16533598 1.0 Yb Yb5 1 0.75000000 0.20028748 0.83292061 1.0 Yb Yb6 1 0.75000000 0.29805010 0.33314617 1.0 Yb Yb7 1 0.25000000 0.70491510 0.66898866 1.0 Yb Yb8 1 0.25000000 0.70077520 0.33268286 1.0 Yb Yb9 1 0.75000000 0.30303776 0.66877354 1.0 Yb Yb10 1 0.75000000 0.19914237 0.16541442 1.0 Mg Mg11 1 0.25000000 0.79791022 0.83617285 1.0 Cu Cu12 1 0.25000000 0.41007325 0.09446438 1.0 Cu Cu13 1 0.75000000 0.58613618 0.90083991 1.0 Cu Cu14 1 0.75000000 0.91331254 0.40327758 1.0 Cu Cu15 1 0.25000000 0.08723134 0.59902134 1.0 Cu Cu16 1 0.25000000 0.41022208 0.23582370 1.0 Cu Cu17 1 0.75000000 0.60125716 0.76804644 1.0 Cu Cu18 1 0.75000000 0.91128726 0.26344027 1.0 Cu Cu19 1 0.25000000 0.08864182 0.73890068 1.0 Cu Cu20 1 0.25000000 0.41679939 0.43885269 1.0 Cu Cu21 1 0.75000000 0.58509123 0.56270862 1.0 Cu Cu22 1 0.75000000 0.91234814 0.06126653 1.0 Cu Cu23 1 0.25000000 0.07808757 0.93401665 1.0 Si Si24 1 0.25000000 0.08634119 0.06367692 1.0 Si Si25 1 0.75000000 0.90595187 0.92952385 1.0 Si Si26 1 0.75000000 0.59148661 0.43332851 1.0 Si Si27 1 0.25000000 0.40913676 0.56839650 1.0 Si Si28 1 0.25000000 0.08079704 0.27207470 1.0 Si Si29 1 0.75000000 0.92305765 0.72865711 1.0 Si Si30 1 0.75000000 0.58044695 0.22632374 1.0 Si Si31 1 0.25000000 0.42858944 0.77535285 1.0 Si Si32 1 0.25000000 0.08420455 0.39477395 1.0 Si Si33 1 0.75000000 0.91632801 0.60616310 1.0 Si Si34 1 0.75000000 0.58055413 0.10388728 1.0 Si Si35 1 0.25000000 0.41693032 0.89520429 1.0