# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0XA' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 1.10300 -1.73500 1.68800 1.000 C1 C 2.07100 -1.09200 1.33100 1.000 C2 C 3.24700 -1.75500 0.72500 1.000 C3 C 3.46600 -3.12100 0.92500 1.000 N4 N 2.10600 0.26700 1.47200 1.000 C5 C 0.81600 0.92500 1.78400 1.000 C6 C -0.27600 0.37700 0.86300 1.000 O7 O 0.07300 0.63700 -0.49800 1.000 C8 C -1.60600 1.05900 1.18700 1.000 N9 N -2.67300 0.46700 0.36900 1.000 C10 C -3.96800 1.09800 0.65500 1.000 C11 C -3.88500 2.59400 0.34400 1.000 C12 C -5.03500 0.46600 -0.20100 1.000 O13 O -6.17200 -0.08300 0.24700 1.000 C14 C -6.85800 -0.53700 -0.82000 1.000 C15 C -8.19600 -1.22900 -0.79500 1.000 C16 C -8.09300 -2.51000 0.03400 1.000 C17 C -9.23900 -0.30000 -0.17000 1.000 C18 C -8.61700 -1.57800 -2.22400 1.000 C19 C -6.12500 -0.25600 -1.91000 1.000 N20 N -5.00700 0.36800 -1.50000 1.000 C21 C -4.31700 0.90300 2.13100 1.000 C22 C 0.97000 2.43100 1.55900 1.000 O23 O 1.59100 2.67400 0.29400 1.000 C24 C 2.50900 3.77100 0.30000 1.000 C25 C 3.59300 3.51700 -0.71800 1.000 C26 C 4.80700 3.23400 -0.31700 1.000 C27 C 5.89700 2.94800 -1.31700 1.000 C28 C 6.51300 1.57900 -1.01100 1.000 C29 C 5.83700 0.51700 -1.87500 1.000 C30 C 6.21700 -0.86200 -1.39800 1.000 O31 O 7.29200 -1.33500 -1.69900 1.000 C32 C 5.27900 -1.63200 -0.56500 1.000 C33 C 4.15200 -1.00800 -0.02500 1.000 C34 C 5.50600 -2.99200 -0.32200 1.000 C35 C 4.59500 -3.72300 0.40400 1.000 C36 C 4.84000 -5.18900 0.65400 1.000 H37 H 2.75400 -3.70500 1.48800 1.000 H38 H 2.92800 0.77200 1.37300 1.000 H39 H 0.55100 0.73500 2.82400 1.000 H40 H -0.37300 -0.69800 1.01400 1.000 H41 H 0.17600 1.57600 -0.70500 1.000 H42 H -1.83800 0.91900 2.24300 1.000 H43 H -1.53100 2.12400 0.97000 1.000 H44 H -2.72000 -0.53200 0.50500 1.000 H45 H -3.63700 2.73400 -0.70800 1.000 H46 H -4.84600 3.06300 0.55600 1.000 H47 H -3.11300 3.05200 0.96300 1.000 H48 H -7.79400 -2.26200 1.05200 1.000 H49 H -9.06100 -3.01100 0.05200 1.000 H50 H -7.35000 -3.17200 -0.41200 1.000 H51 H -9.31300 0.61300 -0.76000 1.000 H52 H -10.20700 -0.80000 -0.15200 1.000 H53 H -8.94000 -0.05100 0.84800 1.000 H54 H -7.87400 -2.24000 -2.67000 1.000 H55 H -9.58500 -2.07800 -2.20600 1.000 H56 H -8.69000 -0.66500 -2.81500 1.000 H57 H -6.38800 -0.48700 -2.93200 1.000 H58 H -3.54500 1.36000 2.75100 1.000 H59 H -5.27800 1.37200 2.34300 1.000 H60 H -4.37600 -0.16300 2.35300 1.000 H61 H -0.01300 2.90100 1.57600 1.000 H62 H 1.58600 2.85400 2.35200 1.000 H63 H 1.98000 4.68900 0.04600 1.000 H64 H 2.95400 3.86800 1.29000 1.000 H65 H 3.36300 3.56700 -1.77100 1.000 H66 H 5.02700 3.19200 0.74100 1.000 H67 H 5.47600 2.94100 -2.32300 1.000 H68 H 6.66600 3.71800 -1.24900 1.000 H69 H 7.58000 1.60200 -1.23200 1.000 H70 H 6.36400 1.34000 0.04200 1.000 H71 H 4.75500 0.63600 -1.81200 1.000 H72 H 6.15400 0.63800 -2.91100 1.000 H73 H 3.98600 0.04800 -0.18100 1.000 H74 H 6.39000 -3.47000 -0.71700 1.000 H75 H 5.40300 -5.31000 1.57900 1.000 H76 H 3.88600 -5.70800 0.73800 1.000 H77 H 5.41000 -5.60800 -0.17600 1.000