# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C27' 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 8.11600 -0.85700 0.09500 1.000 O1 O 7.05200 0.08800 0.22400 1.000 C2 C 5.78500 -0.38800 0.09800 1.000 C3 C 5.57200 -1.73800 -0.14600 1.000 C4 C 4.28500 -2.22600 -0.27500 1.000 C5 C 3.20500 -1.37400 -0.16200 1.000 C6 C 3.41000 -0.01800 0.08300 1.000 C7 C 4.70700 0.47300 0.21800 1.000 C8 C 2.25100 0.90100 0.20400 1.000 C9 C 2.45600 2.25700 0.44900 1.000 C10 C 1.37400 3.10700 0.56100 1.000 C11 C 0.08800 2.61400 0.43100 1.000 C12 C -0.12100 1.26800 0.18800 1.000 C13 C -1.52500 0.73900 0.04600 1.000 C14 C -1.88800 0.79800 -1.20400 1.000 C15 C -3.26700 0.15500 -1.36600 1.000 C16 C -3.53900 0.10500 -2.64000 1.000 C17 C -4.30600 1.07400 -0.69100 1.000 C18 C -5.12600 0.44000 0.41700 1.000 O19 O -5.96900 1.08000 1.00900 1.000 N20 N -4.89600 -0.84900 0.72700 1.000 C21 C -5.69000 -1.45800 1.79700 1.000 C22 C -3.95900 -1.62200 0.09500 1.000 N23 N -3.18700 -1.22500 -0.86300 1.000 N24 N -3.82900 -2.92500 0.51400 1.000 C25 C 0.95400 0.41100 0.06800 1.000 H26 H 9.07100 -0.34800 0.21600 1.000 H27 H 8.01400 -1.62600 0.86100 1.000 H28 H 8.07300 -1.31900 -0.89200 1.000 H29 H 6.41300 -2.40900 -0.23500 1.000 H30 H 4.87100 1.52300 0.41200 1.000 H31 H 4.12400 -3.27700 -0.46400 1.000 H32 H 2.20100 -1.75800 -0.26400 1.000 H33 H 3.45900 2.64300 0.55200 1.000 H34 H 0.79000 -0.63900 -0.12600 1.000 H35 H 1.53200 4.15800 0.75100 1.000 H36 H -0.75600 3.28200 0.52000 1.000 H37 H -1.55900 -0.29600 0.38600 1.000 H38 H -2.20300 1.34200 0.65100 1.000 H39 H -1.93500 1.84100 -1.52000 1.000 H40 H -1.16300 0.26500 -1.81900 1.000 H41 H -2.83000 -0.55800 -3.13700 1.000 H42 H -4.55100 -0.27400 -2.78100 1.000 H43 H -3.46200 1.10500 -3.06700 1.000 H44 H -3.78100 1.93500 -0.27700 1.000 H45 H -4.99100 1.43500 -1.45800 1.000 H46 H -6.32300 -0.69900 2.25600 1.000 H47 H -6.31400 -2.24900 1.38100 1.000 H48 H -5.02300 -1.87900 2.55000 1.000 H49 H -4.43900 -3.28500 1.17600 1.000 H50 H -3.12600 -3.48500 0.14600 1.000