# generated using pymatgen data_Ba4U3BiSe12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.35044996 _cell_length_b 9.18079326 _cell_length_c 15.38430333 _cell_angle_alpha 90.29563036 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba4U3BiSe12 _chemical_formula_sum 'Ba4 U3 Bi1 Se12' _cell_volume 614.44984364 _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 Ba Ba0 1 0.75000000 0.57375744 0.18459947 1.0 Ba Ba1 1 0.25000000 0.42322676 0.82071576 1.0 Ba Ba2 1 0.75000000 0.06887490 0.32630687 1.0 Ba Ba3 1 0.25000000 0.92317816 0.66980086 1.0 U U4 1 0.75000000 0.33526402 0.55758913 1.0 U U5 1 0.25000000 0.17142720 0.05658189 1.0 U U6 1 0.75000000 0.82813863 0.94332282 1.0 Bi Bi7 1 0.25000000 0.67656719 0.43931041 1.0 Se Se8 1 0.75000000 0.85579580 0.50592134 1.0 Se Se9 1 0.25000000 0.16919020 0.49489975 1.0 Se Se10 1 0.75000000 0.33622408 0.99212844 1.0 Se Se11 1 0.25000000 0.66567393 0.00917793 1.0 Se Se12 1 0.25000000 0.51088796 0.61305416 1.0 Se Se13 1 0.75000000 0.46141055 0.39443804 1.0 Se Se14 1 0.25000000 0.01943466 0.89496295 1.0 Se Se15 1 0.75000000 0.98148277 0.10383392 1.0 Se Se16 1 0.25000000 0.80327769 0.27615543 1.0 Se Se17 1 0.75000000 0.19989799 0.71668154 1.0 Se Se18 1 0.25000000 0.29408850 0.21622485 1.0 Se Se19 1 0.75000000 0.70220059 0.78429442 1.0