# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CTW' 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 5.26500 0.79600 1.32100 1.000 O1 O 5.05800 1.30900 2.40400 1.000 C2 C 6.01200 1.53600 0.28400 1.000 C3 C 6.48200 2.82500 0.54400 1.000 C4 C 7.17900 3.51100 -0.42700 1.000 C5 C 7.41300 2.92400 -1.66100 1.000 F6 F 8.09700 3.60100 -2.60900 1.000 C7 C 6.94900 1.64500 -1.92500 1.000 C8 C 6.25600 0.94700 -0.95900 1.000 N9 N 4.81700 -0.45000 1.06900 1.000 C10 C 4.07600 -1.18400 2.09800 1.000 C11 C 5.04800 -1.87500 3.02000 1.000 O12 O 6.23700 -1.76600 2.83600 1.000 C13 C 3.17600 -2.22600 1.43200 1.000 C14 C 2.11000 -1.51800 0.59400 1.000 C15 C 1.22300 -2.54400 -0.06200 1.000 O16 O 1.42300 -3.72600 0.12200 1.000 O17 O 4.59200 -2.61200 4.04500 1.000 P18 P -6.19400 -0.54000 0.52100 1.000 O19 O -7.13100 -1.30800 -0.33000 1.000 O20 O -6.72200 -0.54800 2.04200 1.000 O21 O -4.73400 -1.21500 0.45600 1.000 C22 C -4.08400 -1.54700 -0.77300 1.000 C23 C -2.71800 -2.16900 -0.47500 1.000 C24 C -2.02200 -2.52500 -1.79000 1.000 C25 C -0.65600 -3.14700 -1.49200 1.000 C26 C -0.02300 -3.60900 -2.78000 1.000 O27 O -0.64000 -4.52800 -3.53900 1.000 O28 O 1.03900 -3.15100 -3.12900 1.000 N29 N 0.20600 -2.14900 -0.85500 1.000 N30 N -6.10400 1.04600 -0.03400 1.000 C31 C -5.18100 1.84000 0.78800 1.000 C32 C -5.95900 2.57000 1.85300 1.000 O33 O -7.15900 2.44200 1.91900 1.000 C34 C -4.45300 2.85300 -0.09700 1.000 C35 C -3.56600 2.11100 -1.09800 1.000 C36 C -2.84800 3.10900 -1.97000 1.000 O37 O -3.02700 4.29300 -1.80600 1.000 O38 O -2.00900 2.68300 -2.92700 1.000 O39 O -5.31900 3.36200 2.72700 1.000 H40 H 6.30000 3.28400 1.50500 1.000 H41 H 7.54300 4.50800 -0.22600 1.000 H42 H 7.13400 1.19200 -2.88800 1.000 H43 H 5.89800 -0.05100 -1.16400 1.000 H44 H 4.98500 -0.86100 0.20700 1.000 H45 H 3.46400 -0.48800 2.67100 1.000 H46 H 3.77700 -2.86800 0.78800 1.000 H47 H 2.69200 -2.83100 2.19900 1.000 H48 H 1.50800 -0.87600 1.23700 1.000 H49 H 2.59400 -0.91300 -0.17300 1.000 H50 H 5.25300 -3.03700 4.60900 1.000 H51 H -6.15600 -0.06200 2.65700 1.000 H52 H -4.69500 -2.26000 -1.32600 1.000 H53 H -3.95000 -0.64400 -1.36800 1.000 H54 H -2.10700 -1.45600 0.07900 1.000 H55 H -2.85200 -3.07200 0.12100 1.000 H56 H -2.63300 -3.23800 -2.34400 1.000 H57 H -1.88800 -1.62200 -2.38600 1.000 H58 H -0.78300 -3.99800 -0.82400 1.000 H59 H -0.19500 -4.79300 -4.35600 1.000 H60 H 0.04600 -1.20400 -1.00300 1.000 H61 H -7.01900 1.47100 -0.06400 1.000 H62 H -4.45400 1.17900 1.25900 1.000 H63 H -5.18300 3.45600 -0.63600 1.000 H64 H -3.83500 3.50000 0.52600 1.000 H65 H -2.83500 1.50700 -0.55900 1.000 H66 H -4.18300 1.46300 -1.72000 1.000 H67 H -1.57200 3.36000 -3.46100 1.000 H68 H -5.86000 3.81000 3.39200 1.000