# generated using pymatgen data_LaY4Bi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.36008533 _cell_length_b 9.56965856 _cell_length_c 8.37837948 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaY4Bi3 _chemical_formula_sum 'La4 Y16 Bi12' _cell_volume 991.00977534 _cell_formula_units_Z 4 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 0.72283639 0.25000000 0.66928681 1.0 La La1 1 0.22283639 0.25000000 0.83071319 1.0 La La2 1 0.27716361 0.75000000 0.33071319 1.0 La La3 1 0.77716361 0.75000000 0.16928681 1.0 Y Y4 1 0.56368869 0.06240839 0.31139934 1.0 Y Y5 1 0.06368869 0.43759161 0.18860066 1.0 Y Y6 1 0.43631131 0.56240839 0.68860066 1.0 Y Y7 1 0.93631131 0.93759161 0.81139934 1.0 Y Y8 1 0.43631131 0.93759161 0.68860066 1.0 Y Y9 1 0.93631131 0.56240839 0.81139934 1.0 Y Y10 1 0.56368869 0.43759161 0.31139934 1.0 Y Y11 1 0.06368869 0.06240839 0.18860066 1.0 Y Y12 1 0.50313683 0.25000000 0.97509808 1.0 Y Y13 1 0.00313683 0.25000000 0.52490192 1.0 Y Y14 1 0.49686317 0.75000000 0.02490192 1.0 Y Y15 1 0.99686317 0.75000000 0.47509808 1.0 Y Y16 1 0.78806482 0.25000000 0.16642014 1.0 Y Y17 1 0.28806482 0.25000000 0.33357986 1.0 Y Y18 1 0.21193518 0.75000000 0.83357986 1.0 Y Y19 1 0.71193518 0.75000000 0.66642014 1.0 Bi Bi20 1 0.96314138 0.25000000 0.90421559 1.0 Bi Bi21 1 0.46314138 0.25000000 0.59578441 1.0 Bi Bi22 1 0.03685862 0.75000000 0.09578441 1.0 Bi Bi23 1 0.53685862 0.75000000 0.40421559 1.0 Bi Bi24 1 0.83033693 0.00643397 0.43576498 1.0 Bi Bi25 1 0.33033693 0.49356603 0.06423502 1.0 Bi Bi26 1 0.16966307 0.50643397 0.56423502 1.0 Bi Bi27 1 0.66966307 0.99356603 0.93576498 1.0 Bi Bi28 1 0.16966307 0.99356603 0.56423502 1.0 Bi Bi29 1 0.66966307 0.50643397 0.93576498 1.0 Bi Bi30 1 0.83033693 0.49356603 0.43576498 1.0 Bi Bi31 1 0.33033693 0.00643397 0.06423502 1.0