# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9TN' 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 2.05300 7.05700 -1.47300 1.000 C1 C 11.00800 -2.32900 1.55800 1.000 C2 C 0.70900 -3.63100 -3.36700 1.000 C3 C 1.24200 4.54000 -2.50400 1.000 C4 C -2.20000 2.83700 1.10800 1.000 C5 C -5.06900 -1.59300 2.93600 1.000 C6 C -2.26200 -0.80400 -2.15000 1.000 C7 C 1.60900 5.96600 -0.53400 1.000 C8 C 9.90800 -1.63100 0.75600 1.000 C9 C 8.54700 -1.93400 1.38500 1.000 C10 C 7.44600 -1.23600 0.58400 1.000 C11 C 6.08500 -1.54000 1.21300 1.000 C12 C 4.98500 -0.84100 0.41100 1.000 C13 C 3.62400 -1.14500 1.04100 1.000 O14 O -4.33900 1.06700 1.18800 1.000 C15 C -2.36400 -2.71200 -0.54700 1.000 O16 O -1.59800 -3.27300 -3.05000 1.000 O17 O 2.82800 0.20700 -0.71600 1.000 O18 O 0.78400 3.91900 1.09800 1.000 O19 O -6.56300 0.91400 1.68900 1.000 O20 O -4.32400 -1.72200 -1.49000 1.000 O21 O -6.19300 -1.81000 0.79100 1.000 O22 O -2.84200 -1.50100 1.76000 1.000 O23 O 1.25700 -0.58300 0.62200 1.000 O24 O -0.29300 -2.13100 -1.68100 1.000 O25 O 0.41000 2.52600 -0.59100 1.000 C26 C -0.47900 -2.99900 -2.68800 1.000 C27 C 1.22800 4.78500 -1.01700 1.000 C28 C 2.54100 -0.45700 0.25100 1.000 C29 C 0.79500 3.72100 -0.10100 1.000 C30 C -1.49400 1.60600 0.60000 1.000 C31 C -5.48600 0.40600 1.48000 1.000 C32 C -2.09600 0.49200 0.30700 1.000 C33 C -3.57800 0.21600 0.29200 1.000 C34 C 0.26700 0.10700 -0.18500 1.000 C35 C -3.77300 -2.24800 -0.28100 1.000 C36 C -5.18400 -1.08600 1.49800 1.000 C37 C -0.00500 1.52200 0.37200 1.000 C38 C -1.48300 -1.56200 -1.07400 1.000 C39 C -1.08900 -0.56600 -0.06400 1.000 C40 C -3.83300 -1.19500 0.77800 1.000 H41 H 2.91600 6.71600 -2.04400 1.000 H42 H 1.23900 7.30200 -2.15600 1.000 H43 H 2.32400 7.94300 -0.89900 1.000 H44 H 1.59900 6.14100 0.53200 1.000 H45 H 10.99400 -1.96600 2.58600 1.000 H46 H 10.83600 -3.40500 1.55000 1.000 H47 H 11.97700 -2.11300 1.10900 1.000 H48 H 10.08000 -0.55400 0.76300 1.000 H49 H 9.92100 -1.99400 -0.27200 1.000 H50 H 1.02400 -3.00700 -4.20400 1.000 H51 H 1.52900 -3.72200 -2.65400 1.000 H52 H 0.43500 -4.62000 -3.73400 1.000 H53 H 2.21400 4.14300 -2.79800 1.000 H54 H 0.46300 3.82300 -2.76100 1.000 H55 H 1.06000 5.47800 -3.02900 1.000 H56 H -2.24000 2.80900 2.19700 1.000 H57 H -1.65600 3.72600 0.78700 1.000 H58 H -3.21300 2.86600 0.70700 1.000 H59 H -4.79300 -2.64700 2.92900 1.000 H60 H -4.30500 -1.02100 3.46300 1.000 H61 H -6.02700 -1.47200 3.44300 1.000 H62 H -3.09100 -0.26700 -1.68900 1.000 H63 H -1.60000 -0.09300 -2.64500 1.000 H64 H -2.65000 -1.51100 -2.88300 1.000 H65 H 8.37500 -3.01100 1.37800 1.000 H66 H 8.53300 -1.57200 2.41300 1.000 H67 H 7.61800 -0.16000 0.59100 1.000 H68 H 7.46000 -1.59900 -0.44400 1.000 H69 H 5.91300 -2.61600 1.20600 1.000 H70 H 6.07200 -1.17700 2.24100 1.000 H71 H 5.15700 0.23500 0.41900 1.000 H72 H 4.99900 -1.20400 -0.61700 1.000 H73 H 3.45200 -2.22100 1.03300 1.000 H74 H 3.61100 -0.78200 2.06900 1.000 H75 H -3.96000 0.32000 -0.72400 1.000 H76 H -1.92000 -3.06300 0.38400 1.000 H77 H -2.38600 -3.53100 -1.26600 1.000 H78 H -4.37200 -3.10200 0.03600 1.000 H79 H -4.36100 -2.35900 -2.21600 1.000 H80 H -7.07300 -1.74700 1.18700 1.000 H81 H -2.92000 -2.38900 2.13500 1.000 H82 H 0.58600 0.15600 -1.22600 1.000 H83 H 0.52700 1.66300 1.31300 1.000 H84 H -0.99700 -1.15300 0.84900 1.000