# generated using pymatgen data_SmU3(B6W)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.69451349 _cell_length_b 9.36612097 _cell_length_c 11.44571320 _cell_angle_alpha 90.00201444 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmU3(B6W)2 _chemical_formula_sum 'Sm2 U6 B24 W4' _cell_volume 396.05899306 _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 Sm Sm0 1 0.00000000 0.33695034 0.40799205 1.0 Sm Sm1 1 0.00000000 0.66304966 0.59200795 1.0 U U2 1 0.00000000 0.83673624 0.09226931 1.0 U U3 1 0.00000000 0.16326376 0.90773069 1.0 U U4 1 0.00000000 0.95688803 0.39543967 1.0 U U5 1 0.00000000 0.04311197 0.60456033 1.0 U U6 1 0.00000000 0.45666157 0.10454746 1.0 U U7 1 0.00000000 0.54333843 0.89545254 1.0 B B8 1 0.50000000 0.55393385 0.42971654 1.0 B B9 1 0.50000000 0.44606615 0.57028346 1.0 B B10 1 0.50000000 0.05050107 0.06783847 1.0 B B11 1 0.50000000 0.94949893 0.93216153 1.0 B B12 1 0.50000000 0.74569554 0.42262055 1.0 B B13 1 0.50000000 0.25430446 0.57737945 1.0 B B14 1 0.50000000 0.24292196 0.07555949 1.0 B B15 1 0.50000000 0.75707804 0.92444051 1.0 B B16 1 0.50000000 0.80541468 0.27356849 1.0 B B17 1 0.50000000 0.19458532 0.72643151 1.0 B B18 1 0.50000000 0.30286729 0.22357694 1.0 B B19 1 0.50000000 0.69713271 0.77642306 1.0 B B20 1 0.50000000 0.64742139 0.18652203 1.0 B B21 1 0.50000000 0.35257861 0.81347797 1.0 B B22 1 0.50000000 0.14407041 0.31149563 1.0 B B23 1 0.50000000 0.85592959 0.68850437 1.0 B B24 1 0.50000000 0.98778035 0.21937083 1.0 B B25 1 0.50000000 0.01221965 0.78062917 1.0 B B26 1 0.50000000 0.49050279 0.27840527 1.0 B B27 1 0.50000000 0.50949721 0.72159473 1.0 B B28 1 0.50000000 0.64409392 0.03915553 1.0 B B29 1 0.50000000 0.35590608 0.96084447 1.0 B B30 1 0.50000000 0.13654782 0.46172247 1.0 B B31 1 0.50000000 0.86345218 0.53827753 1.0 W W32 1 0.00000000 0.65112753 0.31435357 1.0 W W33 1 0.00000000 0.34887247 0.68564643 1.0 W W34 1 0.00000000 0.14244657 0.17748346 1.0 W W35 1 0.00000000 0.85755343 0.82251654 1.0