# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'F3J' 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 -6.85900 0.95300 0.87600 1.000 C1 C -5.88000 1.66200 1.81600 1.000 C2 C -4.06400 0.05600 1.09600 1.000 C3 C -5.06400 -0.63400 0.16400 1.000 C4 C -1.02600 4.64400 -2.51100 1.000 C5 C -3.68200 2.47400 1.10600 1.000 C6 C 7.11300 1.69800 -0.36600 1.000 C7 C -2.34300 2.23800 0.53400 1.000 C8 C -1.87200 3.04600 -0.50500 1.000 C9 C -0.61800 2.82300 -1.03700 1.000 C10 C 0.17700 1.79000 -0.53600 1.000 C11 C -0.29100 0.98700 0.49700 1.000 C12 C -1.54000 1.21000 1.03500 1.000 C13 C 2.42100 0.94500 -0.31000 1.000 C14 C 3.08300 0.09400 1.72900 1.000 C15 C 4.31200 -0.24600 1.18000 1.000 C16 C 4.53200 0.02800 -0.17100 1.000 C17 C 6.05000 -1.69600 -0.84800 1.000 C18 C 6.17000 -2.32700 -2.07800 1.000 C19 C 6.45700 -3.80600 0.25600 1.000 O20 O 6.92700 -2.15100 2.49500 1.000 C21 C 6.14300 -1.77600 1.64500 1.000 N22 N 5.29900 -0.81200 1.98500 1.000 C23 C 5.41700 -0.28700 3.34800 1.000 N24 N 2.17100 0.67500 0.96200 1.000 C25 C 6.21400 -2.43100 0.33400 1.000 C26 C 6.55700 -4.42100 -0.97300 1.000 C27 C 6.42200 -3.68300 -2.13800 1.000 N28 N 5.71500 -0.34600 -0.79200 1.000 C29 C 6.59800 0.66400 -1.38000 1.000 N30 N 3.58000 0.63300 -0.87300 1.000 N31 N 1.44400 1.56400 -1.07400 1.000 C32 C -6.47000 -0.52200 0.75700 1.000 C33 C 5.84500 1.82100 -2.05900 1.000 C34 C 5.86100 2.52900 -0.69200 1.000 O35 O -0.15900 3.60700 -2.04800 1.000 O36 O -4.03800 3.60500 1.37400 1.000 N37 N -4.51100 1.43600 1.33100 1.000 N38 N -7.42700 -1.21200 -0.11800 1.000 C39 C -7.08500 -2.63400 -0.25600 1.000 C40 C -8.05600 -3.29800 -1.23500 1.000 N41 N -9.43100 -3.13500 -0.74300 1.000 C42 C -9.77400 -1.71300 -0.60600 1.000 C43 C -8.80300 -1.04900 0.37400 1.000 C44 C -10.38800 -3.82500 -1.61900 1.000 H45 H -7.87000 1.03200 1.27600 1.000 H46 H -6.82100 1.42000 -0.10900 1.000 H47 H -6.09100 2.73100 1.82700 1.000 H48 H -5.98200 1.25700 2.82300 1.000 H49 H -4.01800 -0.48000 2.04400 1.000 H50 H -3.07800 0.06600 0.63200 1.000 H51 H -5.04200 -0.15300 -0.81400 1.000 H52 H -4.79700 -1.68600 0.05700 1.000 H53 H -0.53900 5.19300 -3.31600 1.000 H54 H -1.95300 4.20500 -2.87900 1.000 H55 H -1.24800 5.32500 -1.68900 1.000 H56 H 7.13800 1.32900 0.66000 1.000 H57 H 8.04500 2.17700 -0.66600 1.000 H58 H -2.48900 3.84500 -0.89100 1.000 H59 H 0.32700 0.18900 0.88200 1.000 H60 H -1.90000 0.58700 1.84000 1.000 H61 H 2.87300 -0.11100 2.76800 1.000 H62 H 6.06700 -1.75700 -2.99000 1.000 H63 H 6.56700 -4.38600 1.16000 1.000 H64 H 4.77400 -0.86000 4.01500 1.000 H65 H 6.45200 -0.36900 3.68100 1.000 H66 H 5.11300 0.76000 3.36100 1.000 H67 H 6.74200 -5.48300 -1.02800 1.000 H68 H 6.51400 -4.17200 -3.09700 1.000 H69 H 7.38400 0.23000 -1.99900 1.000 H70 H 1.64100 1.84100 -1.98300 1.000 H71 H -6.48500 -0.98200 1.74500 1.000 H72 H 6.43000 2.33400 -2.82200 1.000 H73 H 4.84600 1.55000 -2.40000 1.000 H74 H 5.00200 2.28800 -0.06500 1.000 H75 H 6.05100 3.60000 -0.75800 1.000 H76 H -6.06700 -2.72800 -0.63300 1.000 H77 H -7.15900 -3.12200 0.71600 1.000 H78 H -7.96200 -2.82800 -2.21500 1.000 H79 H -7.82100 -4.35900 -1.31700 1.000 H80 H -9.70000 -1.22500 -1.57800 1.000 H81 H -10.79200 -1.61900 -0.22800 1.000 H82 H -8.89600 -1.51900 1.35300 1.000 H83 H -9.03700 0.01200 0.45500 1.000 H84 H -10.15100 -4.88900 -1.65000 1.000 H85 H -11.39800 -3.68900 -1.23200 1.000 H86 H -10.32600 -3.40900 -2.62400 1.000