# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J88' 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 2.40100 3.53900 -0.03200 1.000 N1 N 2.56800 2.13300 -0.00100 1.000 C2 C 1.60900 1.37300 0.44600 1.000 C3 C 0.28100 1.79800 0.96100 1.000 O4 O -0.12300 2.94100 1.04400 1.000 N5 N -0.39300 0.69100 1.31500 1.000 C6 C -1.74900 0.69300 1.87100 1.000 C7 C -2.75100 0.60100 0.74900 1.000 C8 C -3.39200 1.73900 0.30200 1.000 C9 C -4.31400 1.65500 -0.72800 1.000 F10 F -4.94000 2.76900 -1.16700 1.000 C11 C -4.59400 0.43100 -1.30900 1.000 C12 C -3.95300 -0.71100 -0.86300 1.000 C13 C -4.26900 -2.04000 -1.50100 1.000 O14 O -3.25000 -2.98400 -1.15600 1.000 C15 C -2.95400 -3.00300 0.24500 1.000 O16 O -2.38600 -1.74200 0.60900 1.000 C17 C -3.02500 -0.62700 0.16200 1.000 C18 C 0.35900 -0.45900 1.08900 1.000 C19 C 0.07300 -1.80300 1.30100 1.000 C20 C 1.00500 -2.77400 0.98800 1.000 C21 C 2.23400 -2.43100 0.46000 1.000 C22 C 2.54400 -1.09100 0.23800 1.000 C23 C 1.60000 -0.10400 0.54800 1.000 C24 C 3.86100 -0.71300 -0.32800 1.000 C25 C 5.03400 -1.22200 0.22900 1.000 C26 C 6.25700 -0.86700 -0.30200 1.000 C27 C 6.32100 -0.00800 -1.38500 1.000 C28 C 5.16100 0.50000 -1.94100 1.000 C29 C 3.93200 0.14800 -1.42200 1.000 H30 H 3.16600 4.01800 -0.38000 1.000 H31 H -1.87000 -0.16100 2.53700 1.000 H32 H -1.91100 1.61500 2.42800 1.000 H33 H -3.17500 2.69500 0.75600 1.000 H34 H -5.31300 0.36600 -2.11200 1.000 H35 H -5.23300 -2.39800 -1.13900 1.000 H36 H -4.30700 -1.92500 -2.58400 1.000 H37 H -3.87200 -3.16800 0.81100 1.000 H38 H -2.24200 -3.80000 0.45800 1.000 H39 H -0.88300 -2.08900 1.71400 1.000 H40 H 0.76900 -3.81500 1.15800 1.000 H41 H 2.95300 -3.20000 0.22100 1.000 H42 H 4.98500 -1.89300 1.07400 1.000 H43 H 7.16600 -1.26100 0.12800 1.000 H44 H 7.28100 0.26700 -1.79700 1.000 H45 H 5.21700 1.17100 -2.78500 1.000 H46 H 3.02700 0.54100 -1.86000 1.000