# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9NS' 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 -5.23300 2.83900 -1.08600 1.000 C1 C -5.95600 1.77000 -1.58500 1.000 C2 C 1.48000 5.13500 1.96100 1.000 C3 C -3.89300 2.69300 -0.79200 1.000 C4 C -5.34100 0.54800 -1.79300 1.000 C5 C -0.25500 -2.39700 -1.82500 1.000 C6 C 1.07400 -2.01100 -1.86900 1.000 C7 C 0.88300 3.85300 1.92400 1.000 C8 C 1.77600 5.46400 0.69100 1.000 C9 C -3.26700 1.46300 -0.99900 1.000 C10 C -0.27200 -2.07900 0.55700 1.000 C11 C -4.00100 0.38800 -1.50300 1.000 C12 C -0.93000 -2.43200 -0.62500 1.000 C13 C 1.74100 -1.65600 -0.70700 1.000 C14 C 1.07400 -1.68900 0.51200 1.000 C15 C 0.85000 3.47700 0.63300 1.000 C16 C -5.18800 -1.77000 2.40700 1.000 C17 C -4.45000 -2.38800 1.51800 1.000 C18 C -1.83100 1.29900 -0.68700 1.000 C19 C -0.99000 -2.11600 1.84400 1.000 C20 C 7.28000 -0.48500 -0.89200 1.000 C21 C 2.92800 -0.61300 1.53400 1.000 C22 C 3.78400 -1.28300 0.45100 1.000 C23 C -3.33300 -0.94300 -1.72900 1.000 C24 C -2.37700 -2.85200 -0.58600 1.000 C25 C 0.29900 2.17600 0.10800 1.000 C26 C -4.55700 -2.02000 0.06100 1.000 C27 C 5.99300 -1.24900 -0.71600 1.000 C28 C 5.09100 -0.50800 0.27300 1.000 N29 N -1.12400 2.33800 -0.20100 1.000 N30 N -3.22800 -1.66200 -0.45200 1.000 O31 O -1.56400 -0.99800 2.32800 1.000 O32 O 8.22900 -0.95100 -1.71900 1.000 O33 O -1.28800 0.22700 -0.86900 1.000 O34 O -1.06400 -3.15600 2.46800 1.000 O35 O 7.45800 0.54600 -0.28800 1.000 O36 O 1.39300 4.45600 -0.10900 1.000 O37 O 1.70900 -1.35300 1.66400 1.000 O38 O 3.04500 -1.27300 -0.77500 1.000 H39 H -5.71800 3.79100 -0.93000 1.000 H40 H -7.00400 1.89000 -1.81400 1.000 H41 H -3.33000 3.52800 -0.40300 1.000 H42 H -5.91100 -0.28200 -2.18200 1.000 H43 H 1.65900 5.73600 2.84100 1.000 H44 H 0.52200 3.28600 2.76900 1.000 H45 H 2.24400 6.38300 0.37000 1.000 H46 H -0.76600 -2.66600 -2.73700 1.000 H47 H 1.59500 -1.98700 -2.81500 1.000 H48 H -3.92500 -1.53200 -2.43000 1.000 H49 H -2.33600 -0.78500 -2.14000 1.000 H50 H -2.62800 -3.37600 -1.50800 1.000 H51 H -2.54100 -3.51300 0.26500 1.000 H52 H 0.83700 1.89100 -0.79600 1.000 H53 H 0.42000 1.39900 0.86300 1.000 H54 H -5.87300 -0.99500 2.09400 1.000 H55 H -5.11100 -2.03300 3.45100 1.000 H56 H -3.76500 -3.16300 1.83100 1.000 H57 H -4.94700 -2.86900 -0.50100 1.000 H58 H -5.23100 -1.17100 -0.05000 1.000 H59 H -1.55700 3.19400 -0.05600 1.000 H60 H -2.02300 -1.07100 3.17500 1.000 H61 H 5.48600 -1.33300 -1.67800 1.000 H62 H 6.21100 -2.24600 -0.33300 1.000 H63 H 9.03800 -0.42600 -1.79900 1.000 H64 H 3.46500 -0.61800 2.48300 1.000 H65 H 2.70500 0.41400 1.24300 1.000 H66 H 4.00300 -2.31100 0.74000 1.000 H67 H 4.87300 0.48900 -0.11100 1.000 H68 H 5.59800 -0.42400 1.23400 1.000