# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CZJ' 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 1.82500 0.56600 0.10000 1.000 C1 C -1.90900 0.76300 -0.03800 1.000 C2 C -2.93200 -0.03600 -0.51100 1.000 C3 C -5.14600 -0.37800 0.30700 1.000 C4 C -6.75700 1.39500 0.94900 1.000 C5 C -9.00800 0.76400 1.83000 1.000 C6 C 5.34900 3.11300 -1.33000 1.000 C7 C 5.41600 1.84400 -0.47800 1.000 C8 C 5.17900 2.20200 0.99000 1.000 C9 C 6.79600 1.19900 -0.63000 1.000 C10 C 8.42000 0.96100 -2.37800 1.000 C11 C 6.83500 -0.10200 0.17700 1.000 C12 C 7.24400 -0.63300 2.46800 1.000 C13 C 5.70800 -1.02200 -0.30200 1.000 C14 C 4.37000 -0.29100 -0.16200 1.000 C15 C 2.04900 -0.66400 -0.51300 1.000 C16 C 0.55300 1.03700 0.25900 1.000 C17 C -0.53000 0.28000 -0.19700 1.000 C18 C -6.60500 0.00000 0.33900 1.000 C19 C -8.23700 1.77800 0.98300 1.000 C20 C -8.85600 -0.63100 1.22000 1.000 C21 C -7.37500 -1.01400 1.18700 1.000 C22 C -8.79500 1.78100 -0.44200 1.000 C23 C -8.64300 0.38700 -1.05200 1.000 C24 C -9.41400 -0.62700 -0.20500 1.000 C25 C -7.16300 0.00300 -1.08500 1.000 C26 C -2.62500 -1.26800 -1.11900 1.000 C27 C -0.31200 -0.96200 -0.81700 1.000 C28 C 0.98700 -1.42300 -0.97500 1.000 C29 C 1.24100 -2.75300 -1.63900 1.000 N30 N 7.11500 -0.41300 3.79100 1.000 N31 N -4.27000 0.37700 -0.38500 1.000 O32 O 7.04000 0.91200 -2.00900 1.000 O33 O 6.65300 0.19600 1.58700 1.000 O34 O 7.89500 -1.57900 2.07000 1.000 O35 O 5.69000 -2.20900 0.49300 1.000 O36 O 3.31900 -1.12200 -0.66000 1.000 O37 O -2.16800 1.95400 0.55200 1.000 O38 O -4.76100 -1.36200 0.90300 1.000 O39 O -1.35900 -1.69200 -1.25600 1.000 O40 O -3.53300 -1.96800 -1.53400 1.000 O41 O 4.41200 0.92400 -0.91200 1.000 H42 H 2.66100 1.14900 0.45600 1.000 H43 H -6.35900 1.39300 1.96400 1.000 H44 H -6.20700 2.11700 0.34600 1.000 H45 H -8.61100 0.76200 2.84500 1.000 H46 H -10.06300 1.03800 1.85400 1.000 H47 H 5.51700 2.85700 -2.37600 1.000 H48 H 4.36600 3.57200 -1.22200 1.000 H49 H 6.11600 3.81300 -1.00000 1.000 H50 H 6.03900 2.75300 1.37300 1.000 H51 H 4.28500 2.81900 1.07400 1.000 H52 H 5.04600 1.28900 1.57000 1.000 H53 H 7.56000 1.88200 -0.25900 1.000 H54 H 8.97800 0.23000 -1.79400 1.000 H55 H 8.52100 0.73300 -3.43900 1.000 H56 H 8.81300 1.95900 -2.18200 1.000 H57 H 7.79600 -0.59400 0.03000 1.000 H58 H 5.87200 -1.28500 -1.34700 1.000 H59 H 4.18700 -0.06400 0.88800 1.000 H60 H 0.38400 1.99200 0.73600 1.000 H61 H -8.34600 2.77200 1.41700 1.000 H62 H -9.40500 -1.35300 1.82400 1.000 H63 H -7.26700 -2.00800 0.75200 1.000 H64 H -6.97800 -1.01600 2.20200 1.000 H65 H -9.85000 2.05500 -0.41900 1.000 H66 H -8.24600 2.50400 -1.04600 1.000 H67 H -9.04100 0.38900 -2.06700 1.000 H68 H -9.30600 -1.62100 -0.64000 1.000 H69 H -10.46900 -0.35400 -0.18100 1.000 H70 H -6.61400 0.72600 -1.68900 1.000 H71 H -7.05400 -0.99100 -1.52000 1.000 H72 H 1.23900 -3.54100 -0.88600 1.000 H73 H 0.45800 -2.94900 -2.37100 1.000 H74 H 2.20900 -2.73000 -2.13900 1.000 H75 H 7.54100 -1.01000 4.42600 1.000 H76 H 6.59600 0.34200 4.10900 1.000 H77 H -4.56200 1.20600 -0.79500 1.000 H78 H 4.99900 -2.83900 0.24400 1.000 H79 H -3.10900 2.17000 0.60300 1.000