# generated using pymatgen data_Tb5PuH18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.37166462 _cell_length_b 6.37654516 _cell_length_c 6.63779690 _cell_angle_alpha 90.00000145 _cell_angle_beta 89.59098508 _cell_angle_gamma 120.02534940 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb5PuH18 _chemical_formula_sum 'Tb5 Pu1 H18' _cell_volume 233.48940862 _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 Tb Tb0 1 0.33617272 0.33634183 0.75012285 1.0 Tb Tb1 1 0.66382728 0.00017011 0.74987715 1.0 Tb Tb2 1 0.66315804 0.66357743 0.25061627 1.0 Tb Tb3 1 1.00000000 0.33523872 0.25000000 1.0 Tb Tb4 1 0.33684196 0.00041939 0.24938373 1.0 Pu Pu5 1 1.00000000 0.66580931 0.75000000 1.0 H H6 1 0.67948738 0.65108452 0.58908191 1.0 H H7 1 0.33644225 0.01655797 0.59484520 1.0 H H8 1 0.97064837 0.32555045 0.59178183 1.0 H H9 1 0.33592983 0.66679161 0.69184178 1.0 H H10 1 1.00000000 0.00411758 0.75000000 1.0 H H11 1 0.66407017 0.33086077 0.80815822 1.0 H H12 1 0.02935163 0.35490208 0.90821817 1.0 H H13 1 0.66355775 0.68011572 0.90515480 1.0 H H14 1 0.32051262 0.97159714 0.91091809 1.0 H H15 1 0.67831191 0.02698195 0.09072069 1.0 H H16 1 0.35044772 0.32371609 0.09106296 1.0 H H17 1 0.97126375 0.64826946 0.09064559 1.0 H H18 1 0.33383253 0.66680157 0.19405424 1.0 H H19 1 0.00000000 0.99918313 0.25000000 1.0 H H20 1 0.66616747 0.33296904 0.30594576 1.0 H H21 1 0.02873625 0.67700471 0.40935441 1.0 H H22 1 0.64955228 0.97326937 0.40893704 1.0 H H23 1 0.32168809 0.34866905 0.40927931 1.0