# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JSX' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C 3.96400 0.45900 -0.01600 1.000 O1 O 5.27600 0.81300 -0.01400 1.000 C2 C 3.60900 -0.88300 -0.01200 1.000 C3 C -2.47300 -0.03800 0.00200 1.000 C4 C -3.52700 0.99800 0.00300 1.000 C5 C -1.12900 0.33300 -0.00300 1.000 C6 C 2.27800 -1.24500 -0.00800 1.000 C7 C 2.98200 1.44000 -0.01500 1.000 C8 C 1.65000 1.08400 -0.01700 1.000 C9 C 1.29000 -0.26200 -0.00700 1.000 C10 C -0.14300 -0.64900 -0.00300 1.000 C11 C -0.50300 -1.99600 0.00100 1.000 C12 C -1.83600 -2.35800 0.00500 1.000 C13 C -2.82000 -1.39100 0.01000 1.000 O14 O -3.22300 2.17400 -0.00100 1.000 O15 O -4.82500 0.63700 0.00700 1.000 H16 H 5.65500 0.91400 0.87000 1.000 H17 H 4.37500 -1.64400 -0.01200 1.000 H18 H -0.85400 1.37700 -0.00600 1.000 H19 H 2.00200 -2.28900 -0.00500 1.000 H20 H 3.26200 2.48300 -0.01400 1.000 H21 H 0.88600 1.84800 -0.01600 1.000 H22 H 0.26300 -2.75800 0.00100 1.000 H23 H -2.10900 -3.40300 0.00700 1.000 H24 H -3.86100 -1.68100 0.01400 1.000 H25 H -5.47800 1.35000 0.00700 1.000