# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CPH' 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 -0.25500 2.32700 -0.14300 1.000 O1 O -0.05500 3.14000 0.73500 1.000 C2 C -1.47600 2.42100 -1.03400 1.000 C3 C -2.04000 1.00300 -1.19100 1.000 C4 C -1.02200 0.13200 -1.92300 1.000 C5 C 3.33000 -1.95500 -1.03900 1.000 C6 C 4.56400 -1.95500 -0.42200 1.000 C7 C 4.94200 -0.90800 0.42000 1.000 C8 C 4.09500 0.15700 0.64500 1.000 O9 O 4.47500 1.16900 1.46600 1.000 C10 C 1.93100 1.23700 0.24900 1.000 O11 O 2.27100 2.26000 1.06700 1.000 C12 C -2.32000 0.40900 0.19100 1.000 O13 O -1.08700 0.22800 0.89000 1.000 C14 C 1.17600 -0.87400 -1.44200 1.000 C15 C -3.00900 -0.92200 0.03500 1.000 O16 O -2.39900 -1.94500 0.23400 1.000 C17 C -4.46000 -0.97600 -0.36900 1.000 O18 O -4.79300 -2.30600 -0.77300 1.000 C19 C -5.33600 -0.57000 0.81800 1.000 O20 O -5.02600 -1.39600 1.94300 1.000 C21 C 0.31500 0.15600 -1.23000 1.000 C22 C -6.81000 -0.74400 0.44800 1.000 C23 C 2.44000 -0.89400 -0.82100 1.000 C24 C 2.82800 0.17800 0.02600 1.000 C25 C 0.68300 1.22200 -0.38200 1.000 C26 C 6.29600 -0.93300 1.08200 1.000 O27 O 5.42100 -2.98500 -0.63700 1.000 O28 O -1.10500 2.94100 -2.31200 1.000 C29 C -1.20200 0.34100 2.31000 1.000 H30 H -2.22100 3.06900 -0.57300 1.000 H31 H -2.96500 1.04100 -1.76500 1.000 H32 H -1.38900 -0.89400 -1.95600 1.000 H33 H -0.90200 0.50200 -2.94100 1.000 H34 H 3.05100 -2.77100 -1.68900 1.000 H35 H 4.93800 1.88800 1.01500 1.000 H36 H 2.02700 2.12200 1.99200 1.000 H37 H -2.96100 1.08700 0.75400 1.000 H38 H 0.88700 -1.68600 -2.09300 1.000 H39 H -4.63200 -0.29000 -1.19800 1.000 H40 H -4.66400 -2.97100 -0.08300 1.000 H41 H -5.14500 0.47300 1.07000 1.000 H42 H -5.17200 -2.33900 1.79000 1.000 H43 H -7.00000 -1.78800 0.19600 1.000 H44 H -7.43400 -0.45500 1.29400 1.000 H45 H -7.04600 -0.11500 -0.41000 1.000 H46 H 7.02300 -0.43800 0.43900 1.000 H47 H 6.24300 -0.41400 2.03800 1.000 H48 H 6.60000 -1.96700 1.24600 1.000 H49 H 6.01500 -2.85300 -1.39000 1.000 H50 H -0.71200 3.82400 -2.27900 1.000 H51 H -0.22400 0.19100 2.76700 1.000 H52 H -1.57400 1.33200 2.56700 1.000 H53 H -1.89500 -0.41500 2.68000 1.000