# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JL2' 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 2.99800 -0.71200 -0.25700 1.000 C1 C -3.37600 -0.31500 -1.72700 1.000 C2 C 3.58800 0.51600 -0.52400 1.000 C3 C 4.96400 0.66000 -0.43500 1.000 C4 C -3.05000 2.49100 0.46300 1.000 C5 C 0.77700 0.20000 -0.02100 1.000 C6 C -1.35200 1.06900 0.08200 1.000 C7 C -0.81400 2.25100 0.63200 1.000 C8 C 0.56400 2.33400 0.83000 1.000 C9 C -1.94900 3.14600 0.86300 1.000 C10 C -3.61200 0.29800 -0.50300 1.000 N11 N 1.60900 -0.85700 -0.35400 1.000 N12 N -0.52400 0.07600 -0.22600 1.000 C13 C 3.78600 -1.79800 0.10000 1.000 N14 N 1.31500 1.29900 0.49500 1.000 C15 C 5.75300 -0.42700 -0.07700 1.000 C16 C 5.16200 -1.65600 0.19100 1.000 N17 N -2.70800 1.24600 -0.00700 1.000 C18 C -4.27200 -1.24500 -2.21600 1.000 C19 C -5.40000 -1.57100 -1.48600 1.000 C20 C -5.63500 -0.96600 -0.26400 1.000 C21 C -4.74600 -0.03200 0.22800 1.000 C22 C -6.86600 -1.32400 0.52800 1.000 C23 C -8.01600 -0.39700 0.13000 1.000 C24 C -9.21900 -0.74600 0.90400 1.000 N25 N -10.14700 -1.01600 1.50200 1.000 O26 O 5.54100 1.86200 -0.69700 1.000 C27 C 4.66900 2.93500 -1.05900 1.000 O28 O 7.10500 -0.28700 0.01200 1.000 C29 C 7.63500 0.10100 1.28100 1.000 O30 O 5.93400 -2.71900 0.54200 1.000 C31 C 5.26000 -3.95200 0.80200 1.000 H32 H -2.49500 -0.06000 -2.29700 1.000 H33 H 2.97400 1.36100 -0.80300 1.000 H34 H -4.05600 2.88200 0.50800 1.000 H35 H 1.00800 3.22600 1.24800 1.000 H36 H -1.90900 4.14300 1.27600 1.000 H37 H 1.22900 -1.69700 -0.65500 1.000 H38 H 3.32700 -2.75300 0.30800 1.000 H39 H -4.09200 -1.71800 -3.17000 1.000 H40 H -6.10000 -2.29800 -1.87100 1.000 H41 H -4.93000 0.44000 1.18200 1.000 H42 H -7.14400 -2.35800 0.32100 1.000 H43 H -6.65900 -1.21000 1.59200 1.000 H44 H -7.73800 0.63700 0.33800 1.000 H45 H -8.22400 -0.51100 -0.93400 1.000 H46 H 5.25600 3.83500 -1.24200 1.000 H47 H 4.12200 2.66900 -1.96400 1.000 H48 H 3.96400 3.11900 -0.24900 1.000 H49 H 7.22100 1.06800 1.56700 1.000 H50 H 7.36800 -0.64500 2.03000 1.000 H51 H 8.72000 0.17600 1.21400 1.000 H52 H 4.55700 -3.81600 1.62500 1.000 H53 H 4.71700 -4.26500 -0.09000 1.000 H54 H 5.99000 -4.71600 1.07000 1.000