# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CWC' 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 5.88700 -2.59600 -0.23100 1.000 N1 N 6.35600 -1.46400 0.58000 1.000 C2 C 7.82400 -1.41800 0.62000 1.000 C3 C 5.80300 -0.19700 0.08400 1.000 C4 C 4.28600 -0.18800 0.28800 1.000 C5 C 3.71000 1.13200 -0.22800 1.000 C6 C 2.21600 1.14100 -0.02600 1.000 O7 O 1.66700 0.18500 0.48000 1.000 N8 N 1.49100 2.21000 -0.40900 1.000 C9 C 0.09400 2.17500 -0.32500 1.000 C10 C -0.59300 0.98300 -0.51900 1.000 C11 C -1.98700 1.00000 -0.42300 1.000 C12 C -2.63000 2.20400 -0.13900 1.000 N13 N -1.93800 3.31100 0.03800 1.000 C14 C -0.62300 3.33100 -0.04000 1.000 C15 C -2.77000 -0.24300 -0.62100 1.000 C16 C -2.54700 -1.04100 -1.73600 1.000 C17 C -3.28000 -2.20200 -1.91900 1.000 C18 C -4.23800 -2.58500 -1.00500 1.000 C19 C -4.48200 -1.80500 0.12000 1.000 C20 C -3.74100 -0.62700 0.32000 1.000 C21 C -4.22500 -0.05100 1.57400 1.000 C22 C -5.17800 -0.87300 2.04300 1.000 N23 N -5.35100 -1.92300 1.18300 1.000 H24 H 6.25500 -3.52800 0.19900 1.000 H25 H 4.79800 -2.60700 -0.24400 1.000 H26 H 6.26200 -2.49300 -1.25000 1.000 H27 H 8.20900 -1.23600 -0.38300 1.000 H28 H 8.14400 -0.61400 1.28300 1.000 H29 H 8.20700 -2.36800 0.99000 1.000 H30 H 6.24800 0.63300 0.63200 1.000 H31 H 6.02700 -0.09300 -0.97800 1.000 H32 H 3.84100 -1.01800 -0.26000 1.000 H33 H 4.06200 -0.29200 1.35000 1.000 H34 H 4.15500 1.96200 0.32000 1.000 H35 H 3.93400 1.23600 -1.28900 1.000 H36 H 1.93700 3.00400 -0.74300 1.000 H37 H -0.06400 0.06700 -0.73800 1.000 H38 H -0.09400 4.26000 0.11600 1.000 H39 H -3.70700 2.22900 -0.06300 1.000 H40 H -1.80000 -0.75600 -2.46200 1.000 H41 H -3.09800 -2.81500 -2.79000 1.000 H42 H -4.80100 -3.49300 -1.16300 1.000 H43 H -5.98400 -2.64700 1.30700 1.000 H44 H -3.88000 0.86200 2.03700 1.000 H45 H -5.73200 -0.72300 2.95800 1.000