# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CAW' 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 -3.54000 -1.27100 -1.50500 1.000 C1 C -4.77600 -1.66200 -2.00400 1.000 C2 C -5.94200 -1.18900 -1.48500 1.000 C3 C -5.93300 -0.27800 -0.41400 1.000 C4 C -7.12800 0.21900 0.13200 1.000 C5 C -7.07900 1.10000 1.17000 1.000 C6 C -5.86000 1.51700 1.69900 1.000 C7 C -4.68200 1.05500 1.19300 1.000 C8 C -4.69500 0.14800 0.12700 1.000 C9 C -3.45700 -0.37400 -0.44700 1.000 C10 C -2.14700 0.04200 0.08500 1.000 O11 O -2.08400 0.90500 0.93800 1.000 N12 N -1.01900 -0.53500 -0.37500 1.000 C13 C 0.17900 -0.15400 0.11100 1.000 O14 O 0.24200 0.70900 0.96500 1.000 N15 N 1.30700 -0.73100 -0.34900 1.000 C16 C 2.60900 -0.31700 0.18000 1.000 O17 O 3.17600 0.67900 -0.67400 1.000 C18 C 4.44200 1.17300 -0.23400 1.000 C19 C 4.93600 2.24800 -1.20400 1.000 O20 O 4.05500 3.37200 -1.15900 1.000 C21 C 5.45100 0.02200 -0.19100 1.000 O22 O 6.70200 0.50200 0.30500 1.000 C23 C 4.92100 -1.07600 0.73700 1.000 O24 O 5.82100 -2.18600 0.72600 1.000 C25 C 3.54400 -1.52800 0.24000 1.000 O26 O 3.00800 -2.50100 1.13800 1.000 H27 H -2.63600 -1.67100 -1.94000 1.000 H28 H -4.81300 -2.36000 -2.82700 1.000 H29 H -6.88300 -1.51600 -1.90000 1.000 H30 H -8.08100 -0.09500 -0.26900 1.000 H31 H -7.99900 1.48100 1.58800 1.000 H32 H -5.84900 2.21600 2.52300 1.000 H33 H -3.74400 1.38600 1.61300 1.000 H34 H -1.06900 -1.22400 -1.05700 1.000 H35 H 1.25700 -1.41900 -1.03000 1.000 H36 H 2.48100 0.09300 1.18100 1.000 H37 H 3.64000 -1.96300 -0.75500 1.000 H38 H 4.33800 1.60300 0.76200 1.000 H39 H 5.94000 2.56100 -0.91900 1.000 H40 H 4.95600 1.84200 -2.21600 1.000 H41 H 5.58700 -0.38200 -1.19400 1.000 H42 H 4.30800 4.09400 -1.75100 1.000 H43 H 7.39000 -0.17600 0.35900 1.000 H44 H 4.83400 -0.68700 1.75100 1.000 H45 H 5.54600 -2.92000 1.29300 1.000 H46 H 2.13300 -2.82900 0.88700 1.000