# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J2V' 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 -1.12900 -1.56800 -0.92300 1.000 C1 C -1.73400 -0.80200 0.07100 1.000 C2 C 2.04900 1.25800 -0.17400 1.000 C3 C -1.97400 -3.51600 -0.02000 1.000 C4 C -2.60300 -2.82100 1.00700 1.000 C5 C -2.48900 -1.44500 1.06000 1.000 C6 C 5.59100 0.49300 -0.44500 1.000 C7 C 1.08900 -0.28100 1.40400 1.000 C8 C 2.34800 -0.81000 1.59000 1.000 C9 C -1.41900 -5.52500 -1.15800 1.000 C10 C -2.64400 1.66700 -0.10500 1.000 C11 C -2.02200 2.92500 -0.01300 1.000 C12 C -2.80100 4.07200 -0.15900 1.000 C13 C -4.15500 3.92000 -0.39000 1.000 C14 C -4.70000 2.64700 -0.46900 1.000 N15 N -3.95100 1.57500 -0.32900 1.000 C16 C -1.58000 0.67100 0.08300 1.000 C17 C -0.41000 1.37600 0.27300 1.000 N18 N -0.68000 2.72200 0.22000 1.000 C19 C 0.92100 0.78000 0.50200 1.000 N20 N 3.38800 -0.34000 0.92600 1.000 C21 C 3.27800 0.66400 0.06900 1.000 N22 N -1.26800 -2.87800 -0.93900 1.000 N23 N 4.41200 1.12900 -0.59700 1.000 O24 O 5.68700 -0.42600 0.34000 1.000 C25 C 6.78800 0.92400 -1.25200 1.000 O26 O -2.08700 -4.86600 -0.08100 1.000 H27 H -0.54400 -1.08200 -1.69100 1.000 H28 H 1.96300 2.07400 -0.87600 1.000 H29 H -3.17800 -3.35000 1.75300 1.000 H30 H -2.97000 -0.88000 1.84400 1.000 H31 H 0.24300 -0.67900 1.94400 1.000 H32 H 2.48400 -1.62700 2.28300 1.000 H33 H -0.34900 -5.32300 -1.10100 1.000 H34 H -1.58900 -6.60000 -1.08900 1.000 H35 H -1.80800 -5.15600 -2.10700 1.000 H36 H -2.35700 5.05400 -0.09300 1.000 H37 H -4.78600 4.78900 -0.50700 1.000 H38 H -5.75900 2.53400 -0.64900 1.000 H39 H -0.02200 3.42600 0.32400 1.000 H40 H 4.35200 1.91000 -1.16800 1.000 H41 H 7.64300 0.29800 -0.99600 1.000 H42 H 6.56800 0.82000 -2.31400 1.000 H43 H 7.02100 1.96500 -1.02900 1.000