# generated using pymatgen data_Lu20Si12C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.16434299 _cell_length_b 8.20058145 _cell_length_c 14.20623710 _cell_angle_alpha 90.00000687 _cell_angle_beta 89.99999999 _cell_angle_gamma 89.97185181 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu20Si12C _chemical_formula_sum 'Lu20 Si12 C1' _cell_volume 718.14220022 _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 Lu Lu0 1 0.49999931 0.99999785 0.33595014 1.0 Lu Lu1 1 0.50000155 0.50000190 0.82947812 1.0 Lu Lu2 1 0.50000155 0.50000190 0.17052188 1.0 Lu Lu3 1 0.49999931 0.99999785 0.66404986 1.0 Lu Lu4 1 0.00000039 0.49999879 0.16350510 1.0 Lu Lu5 1 0.99999950 0.00000241 0.66923789 1.0 Lu Lu6 1 0.99999950 0.00000241 0.33076211 1.0 Lu Lu7 1 0.00000039 0.49999879 0.83649490 1.0 Lu Lu8 1 0.72652873 0.23415551 1.00000000 1.0 Lu Lu9 1 0.75167759 0.74188054 0.50000000 1.0 Lu Lu10 1 0.75217669 0.37944781 0.37950666 1.0 Lu Lu11 1 0.72842319 0.88241740 0.88291102 1.0 Lu Lu12 1 0.72842319 0.88241740 0.11708898 1.0 Lu Lu13 1 0.75217669 0.37944781 0.62049334 1.0 Lu Lu14 1 0.27347503 0.76584473 0.00000000 1.0 Lu Lu15 1 0.24831609 0.25811787 0.50000000 1.0 Lu Lu16 1 0.27158641 0.11758328 0.11708922 1.0 Lu Lu17 1 0.24781463 0.62055102 0.62049321 1.0 Lu Lu18 1 0.24781463 0.62055102 0.37950679 1.0 Lu Lu19 1 0.27158641 0.11758328 0.88291078 1.0 Si Si20 1 0.73879732 0.60082616 0.00000000 1.0 Si Si21 1 0.75504100 0.10529882 0.50000000 1.0 Si Si22 1 0.74498090 0.19931529 0.19969826 1.0 Si Si23 1 0.75331135 0.69746552 0.69695216 1.0 Si Si24 1 0.75331135 0.69746552 0.30304784 1.0 Si Si25 1 0.74498090 0.19931529 0.80030174 1.0 Si Si26 1 0.26120663 0.39917448 1.00000000 1.0 Si Si27 1 0.24494946 0.89470479 0.50000000 1.0 Si Si28 1 0.24669477 0.30253309 0.30304815 1.0 Si Si29 1 0.25501465 0.80068547 0.80030235 1.0 Si Si30 1 0.25501465 0.80068547 0.19969765 1.0 Si Si31 1 0.24669477 0.30253309 0.69695185 1.0 C C32 1 0.50000546 0.00000142 0.00000000 1.0