# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J0T' 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 -7.28400 1.67200 -0.05700 1.000 C1 C -6.76400 2.42500 -1.10700 1.000 C2 C -8.79300 3.69400 -1.20000 1.000 C3 C -9.31600 2.94800 -0.15600 1.000 C4 C -6.47200 0.59300 0.55900 1.000 C5 C -5.20800 0.21500 0.20700 1.000 C6 C -3.66300 -2.65600 0.00000 1.000 C7 C -3.60500 -1.52700 1.03400 1.000 C8 C -2.46800 -0.56900 0.66400 1.000 C9 C 1.65600 -1.29600 0.19300 1.000 C10 C 8.60800 0.80500 0.27700 1.000 C11 C 10.62200 2.07700 -0.03500 1.000 C12 C 10.32100 0.77700 1.96000 1.000 C13 C -8.56600 1.93900 0.41800 1.000 C14 C -7.52100 3.43100 -1.67300 1.000 C15 C -2.30500 -3.36100 -0.05200 1.000 C16 C -1.15500 -1.35300 0.58700 1.000 C17 C -2.33700 -4.45200 -1.12500 1.000 C18 C 2.89300 -0.49100 -0.20900 1.000 C19 C 4.13400 -1.38200 -0.11400 1.000 C20 C 7.27600 0.36600 -0.20800 1.000 C21 C 6.40600 -0.46900 0.43000 1.000 C22 C 9.38400 1.66700 -0.49500 1.000 C23 C 11.08900 1.63200 1.19100 1.000 C24 C 9.08400 0.36200 1.50900 1.000 F25 F -10.56000 3.20900 0.30200 1.000 F26 F 11.37600 2.91200 -0.78200 1.000 N27 N -6.83100 -0.20600 1.58000 1.000 N28 N -5.86200 -1.01200 1.83600 1.000 N29 N -4.87700 -0.79900 1.03700 1.000 N30 N 5.33100 -0.58100 -0.38300 1.000 N31 N 5.53700 0.13300 -1.43300 1.000 N32 N 6.68100 0.71600 -1.36300 1.000 O33 O -1.28700 -2.40900 -0.37100 1.000 O34 O -3.96800 -2.11200 -1.28500 1.000 O35 O -1.11200 -5.18600 -1.09400 1.000 O36 O -2.35900 0.45000 1.66100 1.000 O37 O 2.74300 -0.02600 -1.55200 1.000 S38 S 0.18500 -0.24100 0.08000 1.000 H39 H -5.77000 2.22200 -1.47800 1.000 H40 H -9.38100 4.48200 -1.64600 1.000 H41 H -4.59800 0.64100 -0.57600 1.000 H42 H -4.43400 -3.37100 0.28500 1.000 H43 H -3.42200 -1.94700 2.02300 1.000 H44 H -2.67700 -0.11200 -0.30300 1.000 H45 H 1.54400 -2.14900 -0.47700 1.000 H46 H 1.77100 -1.65100 1.21700 1.000 H47 H 10.69000 0.43300 2.91500 1.000 H48 H -8.97400 1.35700 1.23200 1.000 H49 H -7.11700 4.01500 -2.48800 1.000 H50 H -2.09100 -3.81000 0.91800 1.000 H51 H -0.92600 -1.77600 1.56500 1.000 H52 H -3.17000 -5.12700 -0.93100 1.000 H53 H -2.46200 -3.99300 -2.10500 1.000 H54 H 3.00600 0.36100 0.46000 1.000 H55 H 4.19900 -1.80800 0.88700 1.000 H56 H 4.06200 -2.18500 -0.84700 1.000 H57 H 6.54700 -0.94500 1.38900 1.000 H58 H 9.02000 2.01300 -1.45100 1.000 H59 H 12.05700 1.95400 1.54700 1.000 H60 H 8.48600 -0.30600 2.11100 1.000 H61 H -4.01800 -2.77200 -1.99000 1.000 H62 H -1.06200 -5.89500 -1.75000 1.000 H63 H -1.65700 1.09300 1.49000 1.000 H64 H 2.63800 -0.73300 -2.20400 1.000