# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9NH' 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 -10.83500 3.09200 0.52300 1.000 C1 C -7.75400 0.40300 -0.80800 1.000 C2 C -12.30500 1.17900 0.71400 1.000 N3 N -0.29300 0.88800 -0.15700 1.000 C4 C 6.79100 -0.80400 1.66300 1.000 C5 C 7.90000 -1.56400 1.98300 1.000 C6 C 9.12100 -1.29200 1.39200 1.000 C7 C 9.23600 -0.25900 0.48000 1.000 C8 C 8.13000 0.50500 0.15500 1.000 C9 C 2.09000 0.69600 0.16000 1.000 C10 C 0.99100 1.43500 -0.25000 1.000 C11 C 10.56800 0.03300 -0.16100 1.000 C12 C 1.16500 2.71800 -0.75300 1.000 C13 C -0.03100 3.52000 -1.19700 1.000 C14 C -2.05100 -2.37800 -0.51400 1.000 C15 C -4.32100 -2.02000 -0.33600 1.000 C16 C -1.31000 -4.60300 -0.87400 1.000 C17 C 2.43300 3.26300 -0.84600 1.000 C18 C 3.36800 1.24700 0.07000 1.000 C19 C -0.47600 -0.43600 -0.33100 1.000 C20 C -8.94000 -1.24100 0.48800 1.000 C21 C -6.70500 -1.68400 -0.26200 1.000 C22 C 3.53300 2.53600 -0.44100 1.000 C23 C 4.54500 0.46600 0.50500 1.000 N24 N 5.77900 1.00100 0.41800 1.000 C25 C 6.90100 0.23000 0.74400 1.000 F26 F 11.52600 -0.86600 0.32100 1.000 F27 F 10.45800 -0.10400 -1.54900 1.000 F28 F 10.95800 1.34000 0.14800 1.000 N29 N -4.15900 -0.71500 -0.15800 1.000 C30 C -2.95500 -0.17200 -0.15900 1.000 C31 C -1.83800 -0.99700 -0.33400 1.000 N32 N -3.29400 -2.83900 -0.51000 1.000 N33 N -5.60000 -2.54100 -0.33800 1.000 F34 F 8.24300 1.51400 -0.73600 1.000 O35 O 0.48300 -1.16700 -0.48400 1.000 O36 O 4.40000 -0.66000 0.94200 1.000 O37 O -1.00600 -3.21800 -0.69300 1.000 C38 C -6.66200 -0.43900 -0.87700 1.000 C39 C -8.89500 0.00600 -0.12200 1.000 C40 C -7.85000 -2.08500 0.41400 1.000 N41 N -11.92700 2.47700 1.29000 1.000 C42 C -11.09200 0.24700 0.72200 1.000 N43 N -9.99900 0.86200 -0.04600 1.000 C44 C -9.62100 2.16000 0.53000 1.000 H45 H -11.16100 3.25700 -0.50400 1.000 H46 H -10.56500 4.04600 0.97600 1.000 H47 H -7.71900 1.37300 -1.28200 1.000 H48 H -13.10600 0.73700 1.30700 1.000 H49 H -12.64800 1.32200 -0.31100 1.000 H50 H -1.05200 1.46200 0.03100 1.000 H51 H 5.83900 -1.01800 2.12500 1.000 H52 H 7.81400 -2.37100 2.69500 1.000 H53 H 9.98600 -1.88700 1.64500 1.000 H54 H 1.95700 -0.30200 0.55100 1.000 H55 H -0.41400 4.09700 -0.35600 1.000 H56 H 0.26300 4.19700 -1.99900 1.000 H57 H -0.80700 2.84500 -1.55800 1.000 H58 H -0.38500 -5.16400 -1.00600 1.000 H59 H -1.84000 -4.97600 0.00300 1.000 H60 H -1.93800 -4.72400 -1.75700 1.000 H61 H 2.56200 4.26100 -1.23800 1.000 H62 H -9.82600 -1.54900 1.02100 1.000 H63 H 4.52100 2.96600 -0.51200 1.000 H64 H 5.89000 1.92000 0.13000 1.000 H65 H -2.83400 0.89100 -0.01400 1.000 H66 H -5.73300 -3.50000 -0.39300 1.000 H67 H -5.77500 -0.13100 -1.41100 1.000 H68 H -7.88300 -3.05300 0.89200 1.000 H69 H -12.72300 3.09400 1.34500 1.000 H70 H -10.76600 0.08200 1.74900 1.000 H71 H -11.36200 -0.70700 0.26800 1.000 H72 H -8.82000 2.60200 -0.06300 1.000 H73 H -9.27900 2.01700 1.55500 1.000