# generated using pymatgen data_Tm5PuH18 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.22288481 _cell_length_b 6.21828345 _cell_length_c 6.49094865 _cell_angle_alpha 90.41293732 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.02448113 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm5PuH18 _chemical_formula_sum 'Tm5 Pu1 H18' _cell_volume 217.45973118 _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 Tm Tm0 1 0.33656897 0.33628938 0.74985364 1.0 Tm Tm1 1 0.00027959 0.66371062 0.75014636 1.0 Tm Tm2 1 0.66281240 0.66183748 0.24925087 1.0 Tm Tm3 1 0.00097492 0.33816252 0.25074913 1.0 Tm Tm4 1 0.33523612 0.00000000 0.25000000 1.0 Pu Pu5 1 0.66640283 0.00000000 0.75000000 1.0 H H6 1 0.32241084 0.96939477 0.91040776 1.0 H H7 1 0.65103677 0.67744300 0.91384672 1.0 H H8 1 0.01907564 0.33799477 0.90648389 1.0 H H9 1 0.32432682 0.35233436 0.40981124 1.0 H H10 1 0.02817828 0.67816578 0.41022618 1.0 H H11 1 0.64540274 0.96850626 0.40666619 1.0 H H12 1 0.67689648 0.03149374 0.09333381 1.0 H H13 1 0.35001250 0.32183422 0.08977382 1.0 H H14 1 0.97199346 0.64766564 0.09018876 1.0 H H15 1 0.68108087 0.66200523 0.59351611 1.0 H H16 1 0.97359377 0.32255700 0.58615328 1.0 H H17 1 0.35301507 0.03060523 0.58959224 1.0 H H18 1 0.00875072 0.00000000 0.75000000 1.0 H H19 1 0.99866614 0.00000000 0.25000000 1.0 H H20 1 0.66696203 0.34051874 0.80658757 1.0 H H21 1 0.66668284 0.33348292 0.30389161 1.0 H H22 1 0.33319892 0.66651708 0.19610839 1.0 H H23 1 0.32644229 0.65948126 0.69341243 1.0