# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9LA' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 1.27100 0.93900 -0.22800 1.000 N1 N 2.84100 2.43900 -0.53000 1.000 C2 C 0.66900 2.18000 -0.13700 1.000 C3 C 1.69000 3.12700 -0.33300 1.000 C4 C -0.63300 2.60200 0.09200 1.000 C5 C 0.60900 -0.36100 -0.09300 1.000 C6 C 1.38200 4.49100 -0.29100 1.000 C7 C 3.61500 0.08900 -0.64500 1.000 C8 C -0.90300 -0.18100 -0.24300 1.000 C9 C 0.91800 -0.94900 1.28500 1.000 C10 C -4.92400 -2.72100 -0.63600 1.000 C11 C -4.95600 -0.30200 -0.65600 1.000 C12 C -2.88100 -1.48200 -0.43600 1.000 C13 C 5.51500 -1.90100 -0.96300 1.000 C14 C -3.58600 -0.28700 -0.52000 1.000 O15 O -1.53100 -1.46400 -0.30300 1.000 C16 C -3.55500 -2.69700 -0.50000 1.000 C17 C -5.63800 -1.52100 -0.71500 1.000 C18 C -7.10500 -1.54100 -0.86100 1.000 O19 O -7.72300 -0.49800 -0.93100 1.000 O20 O -7.76000 -2.71800 -0.91800 1.000 C21 C 0.29200 -0.06800 2.36800 1.000 C22 C 0.60200 -0.65600 3.74600 1.000 C23 C 0.02100 -2.06900 3.83900 1.000 C24 C 0.64600 -2.95000 2.75700 1.000 C25 C 0.33700 -2.36200 1.37900 1.000 C26 C -0.92300 3.95100 0.12600 1.000 C27 C 0.08400 4.89200 -0.06400 1.000 C28 C 2.60100 1.15200 -0.47600 1.000 C29 C 3.28000 -1.10300 -1.28800 1.000 C30 C 4.23000 -2.09100 -1.44300 1.000 C31 C 5.85500 -0.71700 -0.32900 1.000 C32 C 4.91300 0.27800 -0.16800 1.000 Cl33 Cl 6.70500 -3.14800 -1.16100 1.000 F34 F -0.21300 6.21000 -0.02400 1.000 F35 F -2.19100 4.36000 0.34900 1.000 H36 H -1.41900 1.87500 0.24200 1.000 H37 H 0.97400 -1.03600 -0.86700 1.000 H38 H 2.15900 5.22600 -0.43500 1.000 H39 H -1.29000 0.37400 0.61100 1.000 H40 H -1.11400 0.36900 -1.16000 1.000 H41 H 1.99800 -0.99000 1.42900 1.000 H42 H -5.44700 -3.66500 -0.68600 1.000 H43 H -5.50300 0.62700 -0.72100 1.000 H44 H -3.05900 0.65400 -0.47500 1.000 H45 H -3.00200 -3.62300 -0.44200 1.000 H46 H -8.72200 -2.68100 -1.01400 1.000 H47 H 0.70600 0.93800 2.30100 1.000 H48 H -0.78700 -0.02700 2.22400 1.000 H49 H 1.68100 -0.69700 3.89000 1.000 H50 H 0.15600 -0.02800 4.51800 1.000 H51 H 0.24100 -2.48800 4.82100 1.000 H52 H -1.05900 -2.02800 3.69600 1.000 H53 H 1.72600 -2.99100 2.90000 1.000 H54 H 0.23300 -3.95600 2.82300 1.000 H55 H -0.74200 -2.32100 1.23500 1.000 H56 H 0.78300 -2.99000 0.60700 1.000 H57 H 2.27800 -1.25300 -1.66200 1.000 H58 H 3.97100 -3.01400 -1.94000 1.000 H59 H 6.85900 -0.57400 0.04300 1.000 H60 H 5.18000 1.20000 0.32600 1.000