# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C01' 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 -2.12100 1.56500 -0.23900 1.000 C1 C -1.11700 0.60000 -0.21600 1.000 C2 C -1.43400 -0.74000 -0.07500 1.000 C3 C -2.76400 -1.12700 0.03300 1.000 C4 C -3.77100 -0.14800 0.00200 1.000 C5 C -3.43200 1.20000 -0.13500 1.000 O6 O -3.35500 -2.33100 0.17100 1.000 N7 N -4.75800 -2.17000 0.23400 1.000 C8 C -5.05100 -0.85600 0.13500 1.000 C9 C -5.73400 -3.25200 0.38300 1.000 O10 O -6.16200 -0.35500 0.15200 1.000 C11 C -0.34000 -1.77600 -0.04500 1.000 C12 C 0.05100 -2.14800 -1.47600 1.000 C13 C 1.23100 -3.12000 -1.44700 1.000 C14 C -1.75900 3.02000 -0.38700 1.000 C15 C -1.80000 3.40900 -1.86700 1.000 C16 C -1.54900 4.91100 -2.00700 1.000 O17 O 0.18300 0.97800 -0.32100 1.000 C18 C 0.82500 0.59200 0.89600 1.000 C19 C 2.22700 0.12600 0.59800 1.000 C20 C 0.87600 1.77100 1.83300 1.000 C21 C 2.74700 -0.96900 1.26300 1.000 C22 C 4.03300 -1.39700 0.99000 1.000 C23 C 4.79900 -0.72900 0.05200 1.000 C24 C 4.27800 0.36500 -0.61300 1.000 C25 C 2.99100 0.79000 -0.34300 1.000 C26 C 6.20100 -1.19500 -0.24500 1.000 C27 C 6.31000 -1.57500 -1.72300 1.000 C28 C 7.18900 -0.06900 0.06700 1.000 O29 O 0.53100 2.92800 1.42100 1.000 O30 O 1.26400 1.61200 3.03700 1.000 H31 H -4.20700 1.95200 -0.15800 1.000 H32 H -6.03200 -3.61100 -0.60300 1.000 H33 H -5.28600 -4.07100 0.94700 1.000 H34 H -6.61000 -2.88100 0.91500 1.000 H35 H 0.52800 -1.37200 0.47600 1.000 H36 H -0.69600 -2.66500 0.47700 1.000 H37 H -0.79700 -2.62000 -1.97300 1.000 H38 H 0.33500 -1.24700 -2.02100 1.000 H39 H 1.56400 -3.31900 -2.46500 1.000 H40 H 2.05000 -2.68100 -0.87600 1.000 H41 H 0.92100 -4.05400 -0.97800 1.000 H42 H -0.75500 3.18600 0.00400 1.000 H43 H -2.47100 3.63100 0.16800 1.000 H44 H -2.77800 3.16400 -2.27900 1.000 H45 H -1.02900 2.85900 -2.40800 1.000 H46 H -0.57000 5.15600 -1.59400 1.000 H47 H -1.57800 5.18800 -3.06100 1.000 H48 H -2.31900 5.46000 -1.46600 1.000 H49 H 0.26400 -0.21800 1.36200 1.000 H50 H 2.14800 -1.49100 1.99500 1.000 H51 H 4.43900 -2.25200 1.50900 1.000 H52 H 4.87700 0.88700 -1.34500 1.000 H53 H 2.58400 1.64500 -0.86200 1.000 H54 H 6.43400 -2.06300 0.37200 1.000 H55 H 5.60600 -2.37700 -1.94500 1.000 H56 H 6.07700 -0.70600 -2.33900 1.000 H57 H 7.32400 -1.91100 -1.93700 1.000 H58 H 7.11100 0.20200 1.12000 1.000 H59 H 8.20300 -0.40500 -0.14800 1.000 H60 H 6.95600 0.80000 -0.54900 1.000