# generated using pymatgen data_SmUB6Ru _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62456510 _cell_length_b 9.39014990 _cell_length_c 11.48635293 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SmUB6Ru _chemical_formula_sum 'Sm4 U4 B24 Ru4' _cell_volume 390.94042955 _cell_formula_units_Z 4 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 0.33799004 0.40736844 1.0 Sm Sm1 1 0.00000000 0.66200996 0.59263156 1.0 Sm Sm2 1 0.00000000 0.83799004 0.09263156 1.0 Sm Sm3 1 0.00000000 0.16200996 0.90736844 1.0 U U4 1 0.00000000 0.95863361 0.39967156 1.0 U U5 1 0.00000000 0.04136639 0.60032844 1.0 U U6 1 0.00000000 0.45863361 0.10032844 1.0 U U7 1 0.00000000 0.54136639 0.89967156 1.0 B B8 1 0.50000000 0.55446702 0.42869086 1.0 B B9 1 0.50000000 0.44553298 0.57130914 1.0 B B10 1 0.50000000 0.05446702 0.07130914 1.0 B B11 1 0.50000000 0.94553298 0.92869086 1.0 B B12 1 0.50000000 0.74365070 0.42234549 1.0 B B13 1 0.50000000 0.25634930 0.57765451 1.0 B B14 1 0.50000000 0.24365070 0.07765451 1.0 B B15 1 0.50000000 0.75634930 0.92234549 1.0 B B16 1 0.50000000 0.80234423 0.27575693 1.0 B B17 1 0.50000000 0.19765577 0.72424307 1.0 B B18 1 0.50000000 0.30234423 0.22424307 1.0 B B19 1 0.50000000 0.69765577 0.77575693 1.0 B B20 1 0.50000000 0.64566166 0.18891433 1.0 B B21 1 0.50000000 0.35433834 0.81108567 1.0 B B22 1 0.50000000 0.14566166 0.31108567 1.0 B B23 1 0.50000000 0.85433834 0.68891433 1.0 B B24 1 0.50000000 0.99193303 0.22038995 1.0 B B25 1 0.50000000 0.00806697 0.77961005 1.0 B B26 1 0.50000000 0.49193303 0.27961005 1.0 B B27 1 0.50000000 0.50806697 0.72038995 1.0 B B28 1 0.50000000 0.64205285 0.03927311 1.0 B B29 1 0.50000000 0.35794715 0.96072689 1.0 B B30 1 0.50000000 0.14205285 0.46072689 1.0 B B31 1 0.50000000 0.85794715 0.53927311 1.0 Ru Ru32 1 0.00000000 0.64662272 0.31871475 1.0 Ru Ru33 1 0.00000000 0.35337728 0.68128525 1.0 Ru Ru34 1 0.00000000 0.14662272 0.18128525 1.0 Ru Ru35 1 0.00000000 0.85337728 0.81871475 1.0