# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CW7' 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 3.18600 -3.66000 2.60000 1.000 O1 O 4.05900 -4.44900 1.78900 1.000 C2 C -4.37800 1.62700 -1.51700 1.000 C3 C -3.13600 1.16000 -1.50000 1.000 C4 C -2.83900 -0.27300 -1.22500 1.000 C5 C -3.60200 -1.23500 -2.16800 1.000 C6 C -3.37100 -2.60100 -1.46800 1.000 C7 C -3.31800 -2.27800 0.04400 1.000 C8 C -3.28300 -0.73900 0.14800 1.000 C9 C -2.27100 -0.27000 1.19200 1.000 C10 C -2.36900 1.22500 1.48700 1.000 C11 C -1.83400 1.41600 2.94600 1.000 C12 C -1.42900 2.90500 2.86000 1.000 C13 C -0.96900 3.05600 1.42900 1.000 C14 C -1.43100 2.08100 0.65900 1.000 C15 C -0.90600 1.88200 -0.73400 1.000 C16 C -1.95200 2.05000 -1.86000 1.000 O17 O -2.36700 3.42400 -1.98700 1.000 O18 O -0.19200 0.64500 -0.83600 1.000 C19 C 0.75600 0.60700 -1.90400 1.000 C20 C 1.16800 -0.83700 -2.16700 1.000 C21 C 1.85100 -1.44300 -0.95100 1.000 C22 C 2.88300 -0.47800 -0.34500 1.000 C23 C 2.48900 0.96100 -0.31000 1.000 O24 O 1.90700 1.37600 -1.54700 1.000 C25 C 3.73500 1.81200 -0.05600 1.000 O26 O 3.35600 3.18400 0.07500 1.000 C27 C 4.45200 4.06900 0.31500 1.000 O28 O 4.03100 -0.74000 -1.20400 1.000 C29 C 4.02800 -2.19500 -0.98700 1.000 O30 O 2.66000 -2.57100 -1.37500 1.000 C31 C 4.01900 -2.22400 0.57300 1.000 O32 O 3.28900 -1.02200 0.92600 1.000 C33 C 5.44600 -2.17300 1.12200 1.000 C34 C 3.29000 -3.46800 1.08600 1.000 O35 O 2.06900 -0.87400 -3.27500 1.000 C36 C -0.10300 4.20400 0.98000 1.000 C37 C -0.88300 5.51300 1.11200 1.000 C38 C 1.15200 4.26800 1.85300 1.000 C39 C -3.79400 1.77000 1.47100 1.000 C40 C -4.56500 -2.81500 0.74900 1.000 O41 O -4.61800 -4.23500 0.60600 1.000 C42 C -5.75200 -4.84000 1.23200 1.000 O43 O -2.13900 -2.83300 0.63000 1.000 H44 H 2.28700 -4.13700 2.99100 1.000 H45 H 3.63500 -2.90100 3.24000 1.000 H46 H -5.20800 0.96200 -1.32900 1.000 H47 H -4.55900 2.67300 -1.72000 1.000 H48 H -1.78200 -0.48400 -1.36200 1.000 H49 H -4.65900 -0.98500 -2.19800 1.000 H50 H -3.15700 -1.22200 -3.15900 1.000 H51 H -4.19800 -3.27800 -1.68000 1.000 H52 H -2.42900 -3.03800 -1.79500 1.000 H53 H -4.29300 -0.40100 0.37200 1.000 H54 H -2.43900 -0.83400 2.12400 1.000 H55 H -1.25800 -0.51700 0.85100 1.000 H56 H -2.62900 1.26300 3.66500 1.000 H57 H -0.97500 0.78100 3.12300 1.000 H58 H -2.27700 3.55100 3.06100 1.000 H59 H -0.60800 3.11200 3.54300 1.000 H60 H -0.12000 2.65500 -0.92400 1.000 H61 H -1.52700 1.73700 -2.83500 1.000 H62 H -3.02200 3.57300 -2.68200 1.000 H63 H 0.30600 1.02600 -2.80400 1.000 H64 H 0.28100 -1.42300 -2.40800 1.000 H65 H 1.11700 -1.74800 -0.20500 1.000 H66 H 1.78300 1.11600 0.50700 1.000 H67 H 4.22000 1.48000 0.86200 1.000 H68 H 4.42500 1.70400 -0.89200 1.000 H69 H 5.15800 4.00700 -0.51300 1.000 H70 H 4.08200 5.09000 0.40200 1.000 H71 H 4.95300 3.78400 1.24100 1.000 H72 H 4.82600 -2.75300 -1.47700 1.000 H73 H 5.93500 -1.26100 0.77900 1.000 H74 H 5.41800 -2.18200 2.21100 1.000 H75 H 6.00400 -3.04000 0.76600 1.000 H76 H 2.46100 -3.81700 0.47100 1.000 H77 H 1.69600 -0.52600 -4.09700 1.000 H78 H 0.18500 4.05600 -0.06000 1.000 H79 H -0.25700 6.34400 0.78800 1.000 H80 H -1.77700 5.46800 0.49000 1.000 H81 H -1.17200 5.66100 2.15300 1.000 H82 H 1.68100 3.31600 1.79900 1.000 H83 H 1.80300 5.06600 1.49600 1.000 H84 H 0.86600 4.46700 2.88600 1.000 H85 H -4.34700 1.36600 2.31900 1.000 H86 H -3.76800 2.85700 1.53900 1.000 H87 H -4.28500 1.47500 0.54400 1.000 H88 H -4.52300 -2.55700 1.80700 1.000 H89 H -5.45400 -2.37100 0.30100 1.000 H90 H -5.73500 -4.62400 2.30100 1.000 H91 H -6.66600 -4.43800 0.79500 1.000 H92 H -5.71900 -5.91900 1.07900 1.000 H93 H -2.08600 -3.79600 0.56900 1.000