# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CJ4' 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 -8.00700 3.97700 -1.74000 1.000 C1 C -6.38200 2.86500 -0.33100 1.000 C2 C -5.02100 2.16600 -0.32700 1.000 C3 C -4.68500 1.71300 1.09600 1.000 C4 C -2.16000 1.82100 1.32100 1.000 C5 C -3.30600 -0.32400 0.89500 1.000 C6 C -4.38800 -2.31900 0.48600 1.000 C7 C -3.17000 -2.97200 0.48500 1.000 C8 C -2.01100 -2.22200 0.70800 1.000 C9 C -0.27200 -3.05000 -0.66000 1.000 C10 C 1.09500 -2.58000 -0.13200 1.000 C11 C 0.30700 -1.85000 0.97100 1.000 C12 C 1.82200 -1.65300 -1.07200 1.000 C13 C 3.73900 -0.26300 -1.64800 1.000 C14 C 5.05800 0.13600 -1.03900 1.000 C15 C 6.25500 -0.45000 -1.26400 1.000 C16 C 6.60800 1.16800 0.13600 1.000 C17 C 7.12000 2.12800 1.03100 1.000 C18 C 6.27400 3.03400 1.59200 1.000 C19 C 4.90700 3.00000 1.27300 1.000 C20 C 4.43200 2.07800 0.40900 1.000 F21 F -3.10100 -4.30500 0.27500 1.000 N22 N -6.70400 3.30000 -1.69700 1.000 N23 N -3.38200 1.04400 1.10000 1.000 N24 N -4.42000 -1.00900 0.69100 1.000 N25 N -2.11900 -0.91200 0.90200 1.000 N26 N -0.76700 -2.83500 0.71700 1.000 N27 N 3.03200 -1.16400 -0.73500 1.000 N28 N 7.18300 0.18700 -0.54500 1.000 N29 N 5.27000 1.16300 -0.16000 1.000 O30 O 1.31800 -1.34700 -2.13200 1.000 H31 H -8.78400 3.29300 -1.39800 1.000 H32 H -7.98300 4.85300 -1.09100 1.000 H33 H -8.22100 4.28900 -2.76200 1.000 H34 H -7.14700 2.17300 0.02000 1.000 H35 H -6.34600 3.73300 0.32700 1.000 H36 H -5.05600 1.29800 -0.98500 1.000 H37 H -4.25600 2.85800 -0.67800 1.000 H38 H -4.65000 2.58100 1.75400 1.000 H39 H -5.45000 1.02100 1.44700 1.000 H40 H -1.94100 1.85700 2.38800 1.000 H41 H -1.32900 1.34900 0.79600 1.000 H42 H -2.30000 2.83400 0.94500 1.000 H43 H -5.30200 -2.86700 0.31700 1.000 H44 H -0.71400 -2.37800 -1.39600 1.000 H45 H -0.28600 -4.09300 -0.97600 1.000 H46 H 1.72400 -3.38900 0.23800 1.000 H47 H 0.75600 -1.93600 1.96100 1.000 H48 H 0.03700 -0.82600 0.71400 1.000 H49 H 3.13400 0.62700 -1.82100 1.000 H50 H 3.91500 -0.77200 -2.59600 1.000 H51 H 6.43200 -1.29300 -1.91600 1.000 H52 H 8.17300 2.14500 1.27000 1.000 H53 H 6.65200 3.77600 2.28000 1.000 H54 H 4.23300 3.71700 1.71700 1.000 H55 H 3.37900 2.06100 0.17000 1.000 H56 H -5.97700 3.89200 -2.06900 1.000 H57 H 3.43500 -1.40900 0.11300 1.000