# generated using pymatgen data_Pu4CoNiB20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.15502778 _cell_length_b 5.56931672 _cell_length_c 11.08192284 _cell_angle_alpha 90.00374250 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pu4CoNiB20 _chemical_formula_sum 'Pu4 Co1 Ni1 B20' _cell_volume 256.44307123 _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 Pu Pu0 1 0.50000000 0.18743144 0.36191415 1.0 Pu Pu1 1 0.50000000 0.81256856 0.63808585 1.0 Pu Pu2 1 0.50000000 0.30385464 0.86452565 1.0 Pu Pu3 1 0.50000000 0.69614536 0.13547435 1.0 Co Co4 1 0.00000000 0.00000000 0.00000000 1.0 Ni Ni5 1 0.00000000 0.50000000 0.50000000 1.0 B B6 1 0.00000000 0.37171444 0.03977270 1.0 B B7 1 0.00000000 0.62828556 0.96022730 1.0 B B8 1 0.00000000 0.12627190 0.54074006 1.0 B B9 1 0.00000000 0.87372810 0.45925994 1.0 B B10 1 0.00000000 0.33994798 0.19731824 1.0 B B11 1 0.00000000 0.66005202 0.80268176 1.0 B B12 1 0.00000000 0.15937290 0.69848754 1.0 B B13 1 0.00000000 0.84062710 0.30151246 1.0 B B14 1 0.00000000 0.02905761 0.18580847 1.0 B B15 1 0.00000000 0.97094239 0.81419153 1.0 B B16 1 0.00000000 0.47062269 0.68692658 1.0 B B17 1 0.00000000 0.52937731 0.31307342 1.0 B B18 1 0.30019754 0.19763280 0.11141018 1.0 B B19 1 0.69980246 0.80236720 0.88858982 1.0 B B20 1 0.30019754 0.80236720 0.88858982 1.0 B B21 1 0.69883328 0.29972849 0.61365631 1.0 B B22 1 0.69980246 0.19763280 0.11141018 1.0 B B23 1 0.30116672 0.70027151 0.38634369 1.0 B B24 1 0.69883328 0.70027151 0.38634369 1.0 B B25 1 0.30116672 0.29972849 0.61365631 1.0