# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FRQ' 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 2.88400 -0.33800 -4.09500 1.000 C1 C 1.70100 -0.58100 -3.42300 1.000 C2 C 0.49100 -0.41500 -4.07700 1.000 C3 C 0.47700 0.00300 -5.42000 1.000 C4 C 1.67700 0.24000 -6.08900 1.000 C5 C 2.87500 0.07000 -5.41800 1.000 N6 N -0.71700 -0.64900 -3.43800 1.000 C7 C -1.88000 -0.48100 -4.09100 1.000 N8 N -1.94500 -0.08700 -5.37200 1.000 C9 C -0.82600 0.16500 -6.08500 1.000 O10 O -0.89300 0.52200 -7.24600 1.000 O11 O -2.91800 -0.69600 -3.49500 1.000 C12 C -0.72700 -1.08200 -2.03800 1.000 C13 C -0.77100 0.14400 -1.12500 1.000 C14 C -0.78100 -0.30700 0.33500 1.000 C15 C -0.82500 0.91900 1.24800 1.000 N16 N -0.83500 0.48500 2.65200 1.000 C17 C -0.87800 1.70500 3.47100 1.000 C18 C -1.05100 1.30600 4.93900 1.000 C19 C -0.01800 0.27100 5.29800 1.000 C20 C 0.65900 -0.37900 4.37600 1.000 C21 C 0.46300 -0.14500 2.90600 1.000 C22 C 0.24000 -0.02100 6.72300 1.000 C23 C -0.78900 -0.48700 7.54200 1.000 C24 C -0.53800 -0.76400 8.87000 1.000 C25 C 0.72600 -0.56900 9.39400 1.000 C26 C 1.75000 -0.10200 8.58900 1.000 C27 C 1.51400 0.17200 7.25800 1.000 F28 F 1.67100 0.63900 -7.38000 1.000 H29 H 3.82600 -0.46700 -3.58200 1.000 H30 H 1.72000 -0.89900 -2.39200 1.000 H31 H 3.80800 0.25500 -5.92900 1.000 H32 H -2.81200 0.01700 -5.79500 1.000 H33 H 0.17400 -1.65700 -1.83000 1.000 H34 H -1.60400 -1.70200 -1.85600 1.000 H35 H -1.67300 0.72000 -1.33400 1.000 H36 H 0.10500 0.76500 -1.30800 1.000 H37 H 0.12000 -0.88200 0.54400 1.000 H38 H -1.65800 -0.92700 0.51800 1.000 H39 H -1.72700 1.49500 1.04000 1.000 H40 H 0.05100 1.54000 1.06600 1.000 H41 H 0.05200 2.26000 3.35000 1.000 H42 H -1.71800 2.32600 3.15900 1.000 H43 H -0.92200 2.18400 5.57200 1.000 H44 H -2.04800 0.89300 5.08800 1.000 H45 H 1.38700 -1.11300 4.69000 1.000 H46 H 0.50800 -1.09900 2.38100 1.000 H47 H 1.25600 0.50500 2.53700 1.000 H48 H -1.77700 -0.63900 7.13400 1.000 H49 H -1.33300 -1.12900 9.50300 1.000 H50 H 0.91600 -0.78300 10.43500 1.000 H51 H 2.73600 0.04600 9.00400 1.000 H52 H 2.31500 0.53700 6.63100 1.000