# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C3W' 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 -3.18700 -1.15500 -0.35900 1.000 C1 C -2.25900 -0.69700 0.55800 1.000 C2 C 0.95900 -0.71900 0.51100 1.000 C3 C -3.24100 1.48500 0.46500 1.000 C4 C -2.28600 0.62300 0.97000 1.000 O5 O 2.83300 1.04600 1.09400 1.000 C6 C -1.21800 -1.63600 1.11000 1.000 C7 C -4.17000 1.02800 -0.45400 1.000 C8 C 2.18300 -0.68300 -0.36700 1.000 C9 C 3.12500 0.38300 0.12800 1.000 C10 C -4.14200 -0.29400 -0.86500 1.000 O11 O 4.71200 -0.04600 -1.54500 1.000 C12 C 4.41800 0.62000 -0.57500 1.000 O13 O 5.26000 1.57300 -0.13200 1.000 O14 O 0.86100 0.04600 1.44700 1.000 N15 N -0.02800 -1.60100 0.25600 1.000 C16 C 0.09000 -2.52600 -0.87400 1.000 F17 F -5.10400 1.87000 -0.94800 1.000 H18 H -3.16200 -2.18500 -0.68300 1.000 H19 H -3.26200 2.51600 0.78600 1.000 H20 H -1.56200 0.98000 1.68700 1.000 H21 H -0.95000 -1.32800 2.12000 1.000 H22 H -1.61900 -2.64900 1.13300 1.000 H23 H 2.68100 -1.65200 -0.33500 1.000 H24 H 1.88800 -0.46000 -1.39300 1.000 H25 H -4.86600 -0.65300 -1.58200 1.000 H26 H 6.08700 1.68900 -0.62100 1.000 H27 H 0.57700 -3.44300 -0.54400 1.000 H28 H -0.90300 -2.76000 -1.25700 1.000 H29 H 0.68400 -2.06300 -1.66200 1.000