# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J2Q' 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 4.32400 1.36600 -0.28000 1.000 C1 C 0.26300 0.16200 0.08800 1.000 C2 C -2.05600 0.65900 -0.04500 1.000 C3 C -2.40500 -0.57800 -0.57600 1.000 C4 C -3.72200 -0.98400 -0.57200 1.000 C5 C -4.70500 -0.15100 -0.03400 1.000 C6 C 7.35000 -1.53800 0.18900 1.000 C7 C 6.36600 -0.38200 -0.00600 1.000 O8 O 5.02900 -0.86500 0.13800 1.000 C9 C 4.02600 0.04200 -0.00700 1.000 C10 C 3.30800 2.29600 -0.42800 1.000 C11 C 1.99000 1.91200 -0.31000 1.000 C12 C 1.67300 0.57700 -0.04000 1.000 O13 O -0.00900 -1.00000 0.32300 1.000 N14 N -0.72200 1.06900 -0.05600 1.000 C15 C -4.35200 1.09000 0.49800 1.000 C16 C -3.03400 1.49000 0.49100 1.000 C17 C -6.12000 -0.58400 -0.03000 1.000 N18 N -7.09000 0.23900 0.50100 1.000 N19 N -6.44900 -1.74200 -0.52700 1.000 C20 C 2.70000 -0.36100 0.12100 1.000 O21 O 2.40400 -1.65700 0.39400 1.000 H22 H 5.35400 1.67600 -0.37400 1.000 H23 H -1.64400 -1.22200 -0.99100 1.000 H24 H -3.99300 -1.94400 -0.98500 1.000 H25 H 8.37000 -1.16900 0.07900 1.000 H26 H 7.22100 -1.96100 1.18500 1.000 H27 H 7.15900 -2.30700 -0.56000 1.000 H28 H 6.55700 0.38700 0.74300 1.000 H29 H 6.49500 0.04100 -1.00200 1.000 H30 H 3.55000 3.32700 -0.63700 1.000 H31 H 1.20300 2.64100 -0.42500 1.000 H32 H -0.50500 2.00800 -0.16700 1.000 H33 H -5.11000 1.73600 0.91400 1.000 H34 H -2.76000 2.45200 0.89900 1.000 H35 H -6.84500 1.10200 0.87200 1.000 H36 H -8.01800 -0.04400 0.50400 1.000 H37 H -5.76600 -2.32100 -0.90100 1.000 H38 H 2.29200 -2.20900 -0.39200 1.000