# generated using pymatgen data_Sm3U(B4W)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.66260877 _cell_length_b 6.06404644 _cell_length_c 11.74232897 _cell_angle_alpha 90.04224274 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm3U(B4W)4 _chemical_formula_sum 'Sm3 U1 B16 W4' _cell_volume 260.79975210 _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 Sm Sm0 1 0.00000000 0.62617176 0.65014747 1.0 Sm Sm1 1 0.00000000 0.37341958 0.35052823 1.0 Sm Sm2 1 0.00000000 0.12655186 0.84889033 1.0 U U3 1 0.00000000 0.87379374 0.14906735 1.0 B B4 1 0.50000000 0.97511677 0.69110051 1.0 B B5 1 0.50000000 0.02308054 0.30666244 1.0 B B6 1 0.50000000 0.47570510 0.80928592 1.0 B B7 1 0.50000000 0.52745818 0.19194896 1.0 B B8 1 0.50000000 0.86449461 0.96894376 1.0 B B9 1 0.50000000 0.13418174 0.03410705 1.0 B B10 1 0.50000000 0.36445776 0.53173567 1.0 B B11 1 0.50000000 0.63661964 0.46655552 1.0 B B12 1 0.50000000 0.78330096 0.81484560 1.0 B B13 1 0.50000000 0.21028863 0.18551987 1.0 B B14 1 0.50000000 0.28501052 0.68501927 1.0 B B15 1 0.50000000 0.71642436 0.31249260 1.0 B B16 1 0.50000000 0.88674565 0.54567149 1.0 B B17 1 0.50000000 0.11281015 0.45311066 1.0 B B18 1 0.50000000 0.38652090 0.95446265 1.0 B B19 1 0.50000000 0.61541346 0.04821532 1.0 W W20 1 0.00000000 0.63050700 0.91816552 1.0 W W21 1 0.00000000 0.37090851 0.08725463 1.0 W W22 1 0.00000000 0.12876995 0.58280988 1.0 W W23 1 0.00000000 0.87224764 0.41345927 1.0