# generated using pymatgen data_YPu4(SiB4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.23073465 _cell_length_b 7.23073465 _cell_length_c 8.17213653 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural YPu4(SiB4)2 _chemical_formula_sum 'Y2 Pu8 Si4 B16' _cell_volume 427.26809337 _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 Y Y0 1 0.00000000 0.00000000 0.50000000 1.0 Y Y1 1 0.50000000 0.50000000 0.50000000 1.0 Pu Pu2 1 0.68163291 0.18163291 0.22987554 1.0 Pu Pu3 1 0.31836709 0.81836709 0.77012446 1.0 Pu Pu4 1 0.31836709 0.81836709 0.22987554 1.0 Pu Pu5 1 0.81836709 0.68163291 0.22987554 1.0 Pu Pu6 1 0.81836709 0.68163291 0.77012446 1.0 Pu Pu7 1 0.68163291 0.18163291 0.77012446 1.0 Pu Pu8 1 0.18163291 0.31836709 0.77012446 1.0 Pu Pu9 1 0.18163291 0.31836709 0.22987554 1.0 Si Si10 1 0.11439335 0.61439335 0.50000000 1.0 Si Si11 1 0.88560665 0.38560665 0.50000000 1.0 Si Si12 1 0.38560665 0.11439335 0.50000000 1.0 Si Si13 1 0.61439335 0.88560665 0.50000000 1.0 B B14 1 0.17275514 0.03982140 0.00000000 1.0 B B15 1 0.82724486 0.96017860 0.00000000 1.0 B B16 1 0.96017860 0.17275514 0.00000000 1.0 B B17 1 0.32724486 0.53982140 0.00000000 1.0 B B18 1 0.03982140 0.82724486 0.00000000 1.0 B B19 1 0.67275514 0.46017860 0.00000000 1.0 B B20 1 0.53982140 0.67275514 0.00000000 1.0 B B21 1 0.46017860 0.32724486 0.00000000 1.0 B B22 1 0.09060504 0.59060504 0.00000000 1.0 B B23 1 0.90939496 0.40939496 0.00000000 1.0 B B24 1 0.40939496 0.09060504 0.00000000 1.0 B B25 1 0.59060504 0.90939496 0.00000000 1.0 B B26 1 0.00000000 0.00000000 0.15882469 1.0 B B27 1 0.00000000 0.00000000 0.84117531 1.0 B B28 1 0.50000000 0.50000000 0.84117531 1.0 B B29 1 0.50000000 0.50000000 0.15882469 1.0