# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J71' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -5.16900 -1.26300 0.00300 1.000 C1 C -4.28200 -2.23800 0.00500 1.000 N2 N -2.98600 -2.00000 0.00400 1.000 C3 C -2.52200 -0.75200 0.00100 1.000 C4 C -3.42700 0.30600 -0.00100 1.000 C5 C -4.78400 0.01000 0.00000 1.000 N6 N -1.15700 -0.51000 0.00100 1.000 C7 C 1.19700 -1.10100 0.00200 1.000 C8 C 1.84400 -0.85500 1.19900 1.000 C9 C 3.14000 -0.37400 1.19800 1.000 C10 C 3.78900 -0.14000 0.00000 1.000 C11 C 3.14200 -0.38700 -1.19600 1.000 C12 C 1.84600 -0.86600 -1.19500 1.000 S13 S 5.44000 0.47400 -0.00100 1.000 O14 O 5.62800 1.11800 -1.25400 1.000 O15 O 5.62500 1.13200 1.24500 1.000 N16 N 6.45100 -0.83700 0.00700 1.000 N17 N -2.95600 1.70900 -0.00400 1.000 O18 O -2.76200 2.28400 -1.06000 1.000 O19 O -2.76200 2.28800 1.04900 1.000 O20 O -5.70400 1.00600 -0.00200 1.000 C21 C -7.08000 0.61800 -0.00100 1.000 C22 C -0.21400 -1.63100 0.00400 1.000 H23 H -4.62800 -3.26100 0.00800 1.000 H24 H -0.82600 0.40200 -0.00200 1.000 H25 H 1.33600 -1.03800 2.13500 1.000 H26 H 3.64500 -0.18100 2.13300 1.000 H27 H 3.64900 -0.20300 -2.13200 1.000 H28 H 1.34100 -1.05900 -2.13000 1.000 H29 H 6.08200 -1.73400 0.01200 1.000 H30 H 7.41300 -0.70900 0.00800 1.000 H31 H -7.29000 0.02300 -0.88900 1.000 H32 H -7.29000 0.02700 0.89100 1.000 H33 H -7.70800 1.50900 -0.00300 1.000 H34 H -0.37300 -2.23800 0.89500 1.000 H35 H -0.37300 -2.24200 -0.88500 1.000