# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CI2' 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 4.92700 1.98400 -0.31900 1.000 C1 C 4.45700 0.56200 -0.15400 1.000 O2 O 5.01700 -0.17200 0.62400 1.000 C3 C 3.29000 0.05500 -0.96200 1.000 C4 C 3.38800 -1.48000 -1.14300 1.000 C5 C 2.07800 -2.07400 -0.55700 1.000 C6 C 1.09500 -0.90200 -0.65500 1.000 C7 C -0.09900 -0.96000 0.27900 1.000 C8 C -0.97100 -2.17300 -0.04200 1.000 C9 C -2.19300 -2.18300 0.87900 1.000 C10 C -3.00400 -0.90300 0.65900 1.000 C11 C -3.43800 -0.83600 -0.81000 1.000 C12 C -4.09800 0.50200 -1.05900 1.000 O13 O -5.18700 0.56900 -1.57700 1.000 C14 C -3.35800 1.75400 -0.64300 1.000 C15 C -2.92900 1.59900 0.82000 1.000 C16 C -2.13300 0.30800 1.00000 1.000 C17 C -1.64700 0.21200 2.44800 1.000 C18 C -0.90400 0.33300 0.07200 1.000 C19 C -0.06600 1.57800 0.34600 1.000 C20 C 1.22300 1.58200 -0.49400 1.000 C21 C 1.98500 0.29300 -0.21000 1.000 C22 C 2.22000 0.15300 1.29600 1.000 H23 H 5.77400 2.16600 0.34200 1.000 H24 H 5.23000 2.15000 -1.35300 1.000 H25 H 4.11500 2.66600 -0.06500 1.000 H26 H 3.26100 0.54900 -1.93300 1.000 H27 H 3.47100 -1.72800 -2.20100 1.000 H28 H 4.25000 -1.86600 -0.59900 1.000 H29 H 1.73400 -2.91600 -1.15800 1.000 H30 H 2.22000 -2.37300 0.48100 1.000 H31 H 0.76500 -0.76700 -1.68500 1.000 H32 H 0.24500 -1.01700 1.31200 1.000 H33 H -1.29900 -2.12000 -1.08000 1.000 H34 H -0.39400 -3.08600 0.11000 1.000 H35 H -2.81300 -3.05000 0.65200 1.000 H36 H -1.86500 -2.23200 1.91700 1.000 H37 H -3.88500 -0.91200 1.30100 1.000 H38 H -2.56500 -0.93800 -1.45500 1.000 H39 H -4.14600 -1.63700 -1.02000 1.000 H40 H -2.47700 1.88500 -1.27100 1.000 H41 H -4.01400 2.61800 -0.74200 1.000 H42 H -2.31200 2.44900 1.10900 1.000 H43 H -3.81400 1.56100 1.45500 1.000 H44 H -2.50600 0.20800 3.11900 1.000 H45 H -1.07900 -0.70900 2.58000 1.000 H46 H -1.01200 1.06800 2.67500 1.000 H47 H -1.24300 0.35700 -0.96400 1.000 H48 H -0.65300 2.46300 0.10300 1.000 H49 H 0.19800 1.60400 1.40300 1.000 H50 H 0.97300 1.60100 -1.55500 1.000 H51 H 1.82800 2.45200 -0.23900 1.000 H52 H 1.26900 0.23500 1.82100 1.000 H53 H 2.66800 -0.81900 1.50500 1.000 H54 H 2.89200 0.94200 1.63300 1.000