# generated using pymatgen data_LiZr(U3Sb5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.31653684 _cell_length_b 9.31635019 _cell_length_c 6.21273605 _cell_angle_alpha 90.00120109 _cell_angle_beta 90.00032742 _cell_angle_gamma 120.00159996 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiZr(U3Sb5)2 _chemical_formula_sum 'Li1 Zr1 U6 Sb10' _cell_volume 466.98920592 _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 Li Li0 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr1 1 0.00000000 0.00000000 0.50000000 1.0 U U2 1 0.38500239 0.99995570 0.74943455 1.0 U U3 1 0.38502314 0.38506361 0.25050048 1.0 U U4 1 0.00002880 0.61501910 0.25063254 1.0 U U5 1 0.99997120 0.38498090 0.74936746 1.0 U U6 1 0.61497686 0.61493639 0.74949952 1.0 U U7 1 0.61499761 0.00004430 0.25056545 1.0 Sb Sb8 1 0.66671607 0.33334648 0.49998709 1.0 Sb Sb9 1 0.33328689 0.66666461 0.99998499 1.0 Sb Sb10 1 0.73613270 0.00003497 0.75478507 1.0 Sb Sb11 1 0.73610665 0.73611396 0.24516308 1.0 Sb Sb12 1 0.33328393 0.66665352 0.50001291 1.0 Sb Sb13 1 0.66671311 0.33333539 0.00001501 1.0 Sb Sb14 1 0.26386730 0.99996503 0.24521493 1.0 Sb Sb15 1 0.26389335 0.26388604 0.75483692 1.0 Sb Sb16 1 0.99998678 0.73610564 0.75479280 1.0 Sb Sb17 1 0.00001322 0.26389436 0.24520720 1.0