# generated using pymatgen data_ErPu4(SiB4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.21583424 _cell_length_b 7.21583424 _cell_length_c 8.13939570 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErPu4(SiB4)2 _chemical_formula_sum 'Er2 Pu8 Si4 B16' _cell_volume 423.80420246 _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 Er Er0 1 0.00000000 0.00000000 0.50000000 1.0 Er Er1 1 0.50000000 0.50000000 0.50000000 1.0 Pu Pu2 1 0.68157903 0.18157903 0.23080152 1.0 Pu Pu3 1 0.31842097 0.81842097 0.76919848 1.0 Pu Pu4 1 0.31842097 0.81842097 0.23080152 1.0 Pu Pu5 1 0.81842097 0.68157903 0.23080152 1.0 Pu Pu6 1 0.81842097 0.68157903 0.76919848 1.0 Pu Pu7 1 0.68157903 0.18157903 0.76919848 1.0 Pu Pu8 1 0.18157903 0.31842097 0.76919848 1.0 Pu Pu9 1 0.18157903 0.31842097 0.23080152 1.0 Si Si10 1 0.11508084 0.61508084 0.50000000 1.0 Si Si11 1 0.88491916 0.38491916 0.50000000 1.0 Si Si12 1 0.38491916 0.11508084 0.50000000 1.0 Si Si13 1 0.61508084 0.88491916 0.50000000 1.0 B B14 1 0.17289235 0.03981037 0.00000000 1.0 B B15 1 0.82710765 0.96018963 0.00000000 1.0 B B16 1 0.96018963 0.17289235 0.00000000 1.0 B B17 1 0.32710765 0.53981037 0.00000000 1.0 B B18 1 0.03981037 0.82710765 0.00000000 1.0 B B19 1 0.67289235 0.46018963 0.00000000 1.0 B B20 1 0.53981037 0.67289235 0.00000000 1.0 B B21 1 0.46018963 0.32710765 0.00000000 1.0 B B22 1 0.09052172 0.59052172 0.00000000 1.0 B B23 1 0.90947828 0.40947828 0.00000000 1.0 B B24 1 0.40947828 0.09052172 0.00000000 1.0 B B25 1 0.59052172 0.90947828 0.00000000 1.0 B B26 1 0.00000000 0.00000000 0.15977276 1.0 B B27 1 0.00000000 0.00000000 0.84022724 1.0 B B28 1 0.50000000 0.50000000 0.84022724 1.0 B B29 1 0.50000000 0.50000000 0.15977276 1.0