# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0SQ' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -1.93200 -3.05300 -0.11800 1.000 C1 C -0.72300 -3.17600 -0.13000 1.000 N2 N -0.17100 -4.40400 -0.18700 1.000 N3 N 0.06600 -2.08400 -0.09000 1.000 C4 C -0.50600 -0.81200 -0.03700 1.000 C5 C -1.83700 -0.52800 -0.01800 1.000 C6 C -1.97800 0.86200 0.03800 1.000 C7 C -3.28300 1.61300 0.07600 1.000 C8 C -4.24000 1.02600 -0.96300 1.000 C9 C -3.90300 1.48900 1.46900 1.000 C10 C -3.03100 3.08900 -0.24000 1.000 N11 N -0.78500 1.39900 0.05400 1.000 N12 N 0.16500 0.37100 0.01200 1.000 C13 C 1.55800 0.53100 0.01800 1.000 C14 C 2.36200 -0.39800 0.66300 1.000 C15 C 3.73400 -0.23800 0.66600 1.000 C16 C 4.30600 0.84800 0.02800 1.000 C17 C 5.80300 1.02000 0.03400 1.000 C18 C 3.50700 1.77500 -0.61600 1.000 C19 C 2.13500 1.61700 -0.62700 1.000 H20 H -0.73800 -5.19000 -0.21900 1.000 H21 H 0.79400 -4.50200 -0.19600 1.000 H22 H 1.03100 -2.18100 -0.09900 1.000 H23 H -2.64100 -1.24800 -0.04300 1.000 H24 H -4.42000 -0.02500 -0.73800 1.000 H25 H -5.18500 1.57000 -0.93500 1.000 H26 H -3.79800 1.11500 -1.95500 1.000 H27 H -3.22100 1.90800 2.21000 1.000 H28 H -4.84800 2.03300 1.49700 1.000 H29 H -4.08300 0.43800 1.69400 1.000 H30 H -2.58900 3.17800 -1.23200 1.000 H31 H -3.97500 3.63300 -0.21200 1.000 H32 H -2.34900 3.50800 0.50100 1.000 H33 H 1.91600 -1.24600 1.16200 1.000 H34 H 4.36000 -0.96000 1.16800 1.000 H35 H 6.23000 0.51600 -0.83300 1.000 H36 H 6.04700 2.08200 -0.00600 1.000 H37 H 6.21500 0.58700 0.94600 1.000 H38 H 3.95700 2.62100 -1.11300 1.000 H39 H 1.51200 2.33900 -1.13300 1.000