# generated using pymatgen data_Y3Np(BRu)16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.45284379 _cell_length_b 7.45284314 _cell_length_c 9.16675276 _cell_angle_alpha 113.88744474 _cell_angle_beta 113.88744781 _cell_angle_gamma 90.22180886 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y3Np(BRu)16 _chemical_formula_sum 'Y3 Np1 B16 Ru16' _cell_volume 417.00693319 _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 Y Y0 1 0.00000000 0.50000000 0.00000000 1.0 Y Y1 1 0.25000000 0.25000000 0.49999900 1.0 Y Y2 1 0.74999900 0.74999900 0.49999900 1.0 Np Np3 1 0.50000000 0.00000000 0.00000000 1.0 B B4 1 0.25046575 0.22243618 0.16595621 1.0 B B5 1 0.75178877 0.44183507 0.16443623 1.0 B B6 1 0.41264845 0.72260116 0.16443623 1.0 B B7 1 0.91549046 0.94352003 0.16595621 1.0 B B8 1 0.83674255 0.02687933 0.33997568 1.0 B B9 1 0.50323313 0.31309636 0.33997568 1.0 B B10 1 0.00388267 0.52483794 0.33738178 1.0 B B11 1 0.33349811 0.81254284 0.33738178 1.0 B B12 1 0.68745716 0.16650189 0.66261922 1.0 B B13 1 0.97516106 0.49611733 0.66261922 1.0 B B14 1 0.47312167 0.66325845 0.66002532 1.0 B B15 1 0.18690364 0.99676787 0.66002532 1.0 B B16 1 0.77739884 0.08735155 0.83556377 1.0 B B17 1 0.27756382 0.24953425 0.83404379 1.0 B B18 1 0.55647997 0.58450954 0.83404379 1.0 B B19 1 0.05816493 0.74821223 0.83556377 1.0 Ru Ru20 1 0.94579513 0.20914429 0.12075317 1.0 Ru Ru21 1 0.44829125 0.40769755 0.12233983 1.0 Ru Ru22 1 0.67404859 0.71464228 0.12233983 1.0 Ru Ru23 1 0.17495805 0.91160788 0.12075317 1.0 Ru Ru24 1 0.57180458 0.04165050 0.37536475 1.0 Ru Ru25 1 0.80356018 0.33371525 0.37536475 1.0 Ru Ru26 1 0.30391429 0.54235728 0.37570018 1.0 Ru Ru27 1 0.07178588 0.83334190 0.37570018 1.0 Ru Ru28 1 0.95764172 0.19608571 0.62429982 1.0 Ru Ru29 1 0.66665710 0.42821412 0.62429982 1.0 Ru Ru30 1 0.16628575 0.69643982 0.62463525 1.0 Ru Ru31 1 0.45834950 0.92819542 0.62463525 1.0 Ru Ru32 1 0.09230245 0.05170875 0.87766017 1.0 Ru Ru33 1 0.58839212 0.32504195 0.87924683 1.0 Ru Ru34 1 0.29085571 0.55420387 0.87924683 1.0 Ru Ru35 1 0.78535772 0.82595041 0.87766017 1.0