# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0JE' 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 5.43300 3.85700 0.10700 1.000 C1 C 4.31800 2.81000 0.08600 1.000 O2 O 4.89300 1.50200 0.08300 1.000 C3 C 4.03200 0.44900 0.06600 1.000 C4 C 2.67100 0.67600 0.04500 1.000 C5 C 4.53000 -0.85300 0.06200 1.000 F6 F 5.86500 -1.06200 0.07800 1.000 C7 C 3.66700 -1.93000 0.04400 1.000 C8 C 2.29600 -1.71800 0.02800 1.000 N9 N 1.19700 -2.56000 0.00900 1.000 C10 C 1.78700 -0.40800 0.02600 1.000 N11 N 0.43400 -0.50200 0.00500 1.000 C12 C 0.07900 -1.76700 0.00100 1.000 C13 C -1.30700 -2.25700 -0.02100 1.000 N14 N -1.70800 -3.56600 -0.02000 1.000 N15 N -3.10800 -3.58500 -0.04400 1.000 C16 C -3.55000 -2.35400 -0.05800 1.000 C17 C -2.45500 -1.48200 -0.03800 1.000 N18 N -2.51000 -0.08200 -0.04000 1.000 C19 C -3.70200 0.54500 -0.05800 1.000 O20 O -4.73100 -0.10400 -0.07300 1.000 N21 N -3.75500 1.89200 -0.06000 1.000 C22 C -5.05200 2.57400 -0.07900 1.000 C23 C -5.52500 2.81200 1.35600 1.000 C24 C -2.51600 2.67400 -0.04100 1.000 C25 C -2.06300 2.94500 -1.47700 1.000 H26 H 6.03900 3.72500 1.00300 1.000 H27 H 6.06100 3.73800 -0.77600 1.000 H28 H 4.99500 4.85500 0.10900 1.000 H29 H 3.69100 2.92900 0.97000 1.000 H30 H 3.71200 2.94200 -0.81000 1.000 H31 H 2.29000 1.68600 0.04400 1.000 H32 H 4.05800 -2.93700 0.04100 1.000 H33 H 1.21500 -3.53000 0.00100 1.000 H34 H -1.12700 -4.34300 -0.00700 1.000 H35 H -4.58800 -2.05800 -0.07700 1.000 H36 H -1.68900 0.43500 -0.02700 1.000 H37 H -4.95100 3.53100 -0.59200 1.000 H38 H -5.78000 1.95500 -0.60400 1.000 H39 H -5.62600 1.85600 1.86900 1.000 H40 H -4.79700 3.43100 1.88100 1.000 H41 H -6.49000 3.32000 1.34100 1.000 H42 H -2.69200 3.62100 0.47000 1.000 H43 H -1.74200 2.11500 0.48500 1.000 H44 H -2.83800 3.50400 -2.00300 1.000 H45 H -1.14200 3.52700 -1.46300 1.000 H46 H -1.88800 1.99900 -1.98800 1.000