# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'HXA' 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 -0.92400 -0.26300 -8.61900 1.000 O1 O -0.42200 -1.35900 -8.54000 1.000 O2 O -1.92200 -0.04400 -9.49000 1.000 C3 C -0.43100 0.85600 -7.74000 1.000 C4 C 0.70000 0.34400 -6.84800 1.000 C5 C 1.19300 1.46400 -5.96900 1.000 C6 C 1.27000 1.29500 -4.67300 1.000 C7 C 1.03100 -0.06800 -4.07600 1.000 C8 C 2.18400 -0.43200 -3.17700 1.000 C9 C 1.98600 -0.59900 -1.89300 1.000 C10 C 0.64700 -0.26600 -1.28700 1.000 C11 C 0.04000 -1.51100 -0.69400 1.000 C12 C -0.37900 -1.50800 0.54500 1.000 C13 C -0.41500 -0.22000 1.32600 1.000 C14 C -1.78800 -0.02800 1.91700 1.000 C15 C -1.92400 0.18900 3.20100 1.000 C16 C -0.70400 0.33800 4.07300 1.000 C17 C -0.79600 1.62800 4.84800 1.000 C18 C -0.65200 1.62100 6.15000 1.000 C19 C -0.22700 0.35900 6.85500 1.000 C20 C 0.96000 0.65100 7.73600 1.000 C21 C 0.93600 0.31100 9.00100 1.000 C22 C -0.20000 -0.51900 9.53700 1.000 C23 C 0.36100 -1.73500 10.27700 1.000 H24 H -2.23900 -0.76300 -10.05400 1.000 H25 H -1.25000 1.21600 -7.11700 1.000 H26 H -0.06300 1.67100 -8.36300 1.000 H27 H 1.51900 -0.01500 -7.47100 1.000 H28 H 0.33200 -0.47000 -6.22500 1.000 H29 H 1.48400 2.40700 -6.40800 1.000 H30 H 1.50500 2.13100 -4.03100 1.000 H31 H 0.94600 -0.80400 -4.87500 1.000 H32 H 0.10800 -0.05300 -3.49500 1.000 H33 H 3.17400 -0.55600 -3.59200 1.000 H34 H 2.78300 -0.97500 -1.26800 1.000 H35 H -0.01200 0.12700 -2.05900 1.000 H36 H 0.77900 0.48100 -0.50500 1.000 H37 H -0.04700 -2.40600 -1.29300 1.000 H38 H -0.70100 -2.42900 1.00900 1.000 H39 H -0.18400 0.61300 0.66200 1.000 H40 H 0.32200 -0.26000 2.12800 1.000 H41 H -2.66000 -0.06900 1.28000 1.000 H42 H -2.91000 0.26000 3.63500 1.000 H43 H 0.18900 0.35200 3.44900 1.000 H44 H -0.64900 -0.49900 4.76800 1.000 H45 H -0.98000 2.55700 4.33000 1.000 H46 H -0.83800 2.52100 6.71800 1.000 H47 H 0.04400 -0.39500 6.11700 1.000 H48 H -1.05000 -0.01000 7.46600 1.000 H49 H 1.83000 1.14000 7.32400 1.000 H50 H 1.73200 0.62700 9.65900 1.000 H51 H -0.82600 -0.85500 8.71000 1.000 H52 H -0.79600 0.08000 10.22400 1.000 H53 H -0.46000 -2.33600 10.66500 1.000 H54 H 0.95800 -2.33500 9.59000 1.000 H55 H 0.98700 -1.39900 11.10400 1.000