# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9AO' 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 11.74000 -1.37500 -1.26200 1.000 N1 N 4.10600 1.35100 1.35800 1.000 C2 C 10.36100 -1.56900 -0.68700 1.000 O3 O -3.41100 1.17000 -1.02400 1.000 N4 N 3.45900 0.27500 -0.60200 1.000 N5 N 6.14900 0.46400 0.68000 1.000 C6 C 8.20300 -0.69800 0.03900 1.000 O7 O -4.75600 -0.69300 -0.44900 1.000 C8 C -3.94800 -1.29400 0.22700 1.000 N9 N -3.98700 -2.64000 0.28700 1.000 C10 C -5.00500 -3.37700 -0.46500 1.000 C11 C -4.83100 -4.85600 -0.22900 1.000 C12 C -5.49100 -5.46900 0.82000 1.000 C13 C -5.33300 -6.82400 1.03800 1.000 C14 C -4.51200 -7.56900 0.20400 1.000 O15 O -4.35500 -8.90200 0.41700 1.000 C16 C -3.85100 -6.95100 -0.84700 1.000 C17 C -4.01700 -5.59600 -1.06500 1.000 C18 C -2.90000 -0.53500 1.00000 1.000 N19 N -3.33000 0.85500 1.17000 1.000 C20 C -3.56000 1.62700 0.09000 1.000 C21 C -4.00200 3.05700 0.26500 1.000 C22 C -2.95500 3.81500 1.03800 1.000 C23 C -1.63700 3.79300 0.62100 1.000 C24 C -0.67600 4.48900 1.33000 1.000 C25 C -1.03200 5.20800 2.45600 1.000 C26 C -2.35100 5.23100 2.87200 1.000 C27 C -3.31200 4.53800 2.16000 1.000 C28 C -4.18900 3.69400 -1.08800 1.000 C29 C -5.38500 4.31200 -1.40200 1.000 C30 C -5.55600 4.89700 -2.64300 1.000 C31 C -4.53100 4.86400 -3.56900 1.000 C32 C -3.33400 4.24700 -3.25500 1.000 C33 C -3.16100 3.66700 -2.01200 1.000 C34 C -1.57700 -0.56900 0.23300 1.000 C35 C -0.48300 0.09300 1.07400 1.000 C36 C 0.84100 0.05900 0.30800 1.000 N37 N 1.88800 0.69200 1.11300 1.000 C38 C 3.16100 0.77900 0.63100 1.000 C39 C 5.33300 1.52400 0.84600 1.000 O40 O 5.71000 2.63800 0.53100 1.000 C41 C 7.49000 0.65300 0.12100 1.000 N42 N 9.54400 -0.50900 -0.52100 1.000 O43 O 9.98500 -2.67900 -0.37300 1.000 C44 C 12.45300 -2.72600 -1.34400 1.000 H45 H 11.66000 -0.94500 -2.26000 1.000 H46 H 12.30900 -0.70200 -0.62100 1.000 H47 H 4.37800 0.26200 -0.91100 1.000 H48 H 5.84900 -0.42300 0.93100 1.000 H49 H 8.28300 -1.12800 1.03700 1.000 H50 H 7.63400 -1.37100 -0.60200 1.000 H51 H -3.34000 -3.12000 0.82700 1.000 H52 H -5.99700 -3.07000 -0.13100 1.000 H53 H -4.89800 -3.16400 -1.52800 1.000 H54 H -6.13100 -4.88900 1.46800 1.000 H55 H -5.84800 -7.30300 1.85800 1.000 H56 H -4.99700 -9.45300 -0.05100 1.000 H57 H -3.21100 -7.52800 -1.49800 1.000 H58 H -3.50600 -5.11600 -1.88600 1.000 H59 H -2.76600 -0.99600 1.97800 1.000 H60 H -3.45000 1.22000 2.06100 1.000 H61 H -4.94500 3.08100 0.81100 1.000 H62 H -1.35800 3.23100 -0.25800 1.000 H63 H 0.35400 4.47000 1.00500 1.000 H64 H -0.28100 5.75100 3.01000 1.000 H65 H -2.62900 5.79300 3.75100 1.000 H66 H -4.34300 4.56000 2.48300 1.000 H67 H -6.18600 4.33700 -0.67800 1.000 H68 H -6.49100 5.37900 -2.88800 1.000 H69 H -4.66400 5.32100 -4.53900 1.000 H70 H -2.53300 4.22100 -3.97900 1.000 H71 H -2.22700 3.18400 -1.76700 1.000 H72 H -1.30200 -1.60400 0.02900 1.000 H73 H -1.68800 -0.03000 -0.70700 1.000 H74 H -0.75800 1.12700 1.27900 1.000 H75 H -0.37200 -0.44600 2.01500 1.000 H76 H 1.11600 -0.97600 0.10300 1.000 H77 H 0.73000 0.59800 -0.63300 1.000 H78 H 1.67600 1.05000 1.98900 1.000 H79 H 7.41000 1.08300 -0.87800 1.000 H80 H 8.06000 1.32600 0.76200 1.000 H81 H 9.84500 0.37800 -0.77100 1.000 H82 H 13.45100 -2.58600 -1.76000 1.000 H83 H 12.53300 -3.15600 -0.34500 1.000 H84 H 11.88400 -3.39900 -1.98500 1.000 H85 H 2.75100 -0.07000 -1.16900 1.000