# generated using pymatgen data_ZrU3Sb5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.34303366 _cell_length_b 9.34281653 _cell_length_c 6.27475661 _cell_angle_alpha 90.00044537 _cell_angle_beta 89.99963896 _cell_angle_gamma 120.00170982 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrU3Sb5 _chemical_formula_sum 'Zr2 U6 Sb10' _cell_volume 474.33565137 _cell_formula_units_Z 2 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 Zr Zr0 1 -0.00000471 0.00000516 0.00000356 1.0 Zr Zr1 1 -0.00000575 0.00000644 0.49999110 1.0 U U2 1 0.38616954 -0.00000894 0.74572240 1.0 U U3 1 0.38614348 0.38614909 0.25424576 1.0 U U4 1 0.00002564 0.61385142 0.25427306 1.0 U U5 1 -0.00002631 0.38614858 0.74573645 1.0 U U6 1 0.61383669 0.61384893 0.74574872 1.0 U U7 1 0.61386022 0.00002633 0.25427626 1.0 Sb Sb8 1 0.66666464 0.33334751 0.49998809 1.0 Sb Sb9 1 0.33332633 0.66668319 0.00000892 1.0 Sb Sb10 1 0.73194084 0.00001145 0.74962339 1.0 Sb Sb11 1 0.73196864 0.73196909 0.25033599 1.0 Sb Sb12 1 0.33333568 0.66666819 0.49999498 1.0 Sb Sb13 1 0.66667798 0.33333407 0.00001737 1.0 Sb Sb14 1 0.26808603 0.00000333 0.25038041 1.0 Sb Sb15 1 0.26799622 0.26800096 0.74964743 1.0 Sb Sb16 1 0.00000051 0.73191743 0.74962959 1.0 Sb Sb17 1 0.00000534 0.26803577 0.25037553 1.0