# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JUS' 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 -0.84900 0.42400 -0.97600 1.000 C1 C -1.53200 0.64500 0.20600 1.000 C2 C -0.93500 0.35400 1.41800 1.000 C3 C 0.34800 -0.15900 1.45400 1.000 C4 C 1.03900 -0.38300 0.27400 1.000 C5 C 0.43700 -0.09000 -0.94700 1.000 C6 C 3.33700 -0.02000 0.18500 1.000 C7 C 3.10100 1.34600 0.14800 1.000 C8 C 4.15700 2.22800 0.02800 1.000 C9 C 5.45700 1.75700 -0.05600 1.000 C10 C 5.71000 0.40300 -0.02100 1.000 C11 C 4.65100 -0.50100 0.10100 1.000 C12 C -2.93100 1.20500 0.17200 1.000 C13 C -3.93900 0.05700 0.10200 1.000 C14 C -5.35900 0.62500 0.06800 1.000 C15 C -6.36700 -0.52400 -0.00200 1.000 C16 C -7.78700 0.04500 -0.03600 1.000 C17 C -8.79500 -1.10400 -0.10600 1.000 C18 C 4.90700 -1.90900 0.13800 1.000 O19 O 1.11000 -0.30900 -2.10800 1.000 N20 N 5.11000 -3.02700 0.16700 1.000 O21 O 2.30100 -0.88800 0.30800 1.000 H22 H -1.31900 0.64800 -1.92200 1.000 H23 H -1.47200 0.52800 2.33900 1.000 H24 H -3.10900 1.79100 1.07400 1.000 H25 H -3.04500 1.84300 -0.70400 1.000 H26 H 0.81300 -0.38500 2.40300 1.000 H27 H 1.63200 0.44700 -2.40900 1.000 H28 H 2.09000 1.72000 0.21200 1.000 H29 H 3.96800 3.29100 -0.00000 1.000 H30 H 6.27600 2.45500 -0.14900 1.000 H31 H 6.72500 0.04000 -0.08800 1.000 H32 H -3.76000 -0.52900 -0.80000 1.000 H33 H -3.82400 -0.58100 0.97800 1.000 H34 H -5.53700 1.21100 0.97000 1.000 H35 H -5.47300 1.26300 -0.80800 1.000 H36 H -6.18800 -1.10900 -0.90400 1.000 H37 H -6.25200 -1.16100 0.87400 1.000 H38 H -7.96500 0.63100 0.86500 1.000 H39 H -7.90100 0.68300 -0.91300 1.000 H40 H -9.80600 -0.69800 -0.13100 1.000 H41 H -8.61600 -1.68900 -1.00800 1.000 H42 H -8.68000 -1.74200 0.77000 1.000