# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C1P' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -2.53400 -1.87200 -0.33800 1.000 C1 C -3.52300 -2.47300 0.35300 1.000 O2 O -3.33400 -2.82600 1.50100 1.000 N3 N -4.72000 -2.68300 -0.22800 1.000 C4 C -5.84700 -3.23700 0.53800 1.000 C5 C -7.07000 -2.33900 0.31900 1.000 O6 O -7.28100 -2.16500 -1.08400 1.000 C7 C -6.20700 -1.50700 -1.76000 1.000 C8 C -4.94200 -2.35800 -1.64600 1.000 C9 C -1.27000 -1.54400 0.32600 1.000 C10 C -0.66000 -0.33000 -0.32700 1.000 O11 O -1.02900 0.01500 -1.42900 1.000 N12 N 0.29600 0.37100 0.31400 1.000 C13 C 0.81400 1.60900 -0.27200 1.000 C14 C 2.22700 1.86900 0.25100 1.000 C15 C 3.16500 0.76500 -0.24200 1.000 S16 S 4.84100 1.07400 0.37900 1.000 O17 O 5.39600 2.22900 -0.23500 1.000 O18 O 4.89200 0.89700 1.78800 1.000 C19 C 5.79900 -0.26000 -0.26100 1.000 C20 C 6.41900 -0.13900 -1.49000 1.000 C21 C 7.17000 -1.18500 -1.99200 1.000 C22 C 7.30200 -2.35200 -1.26300 1.000 C23 C 6.68300 -2.47300 -0.03300 1.000 C24 C 5.93600 -1.42500 0.47000 1.000 C25 C -0.09700 2.77600 0.11600 1.000 C26 C -1.47700 2.57700 -0.51300 1.000 C27 C -2.37400 3.72700 -0.13100 1.000 C28 C -2.42900 4.85500 -0.92800 1.000 C29 C -3.25100 5.90900 -0.57800 1.000 C30 C -4.01800 5.83600 0.57000 1.000 C31 C -3.96400 4.70700 1.36600 1.000 C32 C -3.14500 3.65100 1.01400 1.000 C33 C -0.30800 -2.72700 0.20300 1.000 C34 C 0.96200 -2.43700 1.00600 1.000 C35 C 0.61600 -2.35000 2.49400 1.000 C36 C 1.97500 -3.56100 0.78300 1.000 H37 H -2.65800 -1.66000 -1.27700 1.000 H38 H -6.06700 -4.24700 0.19000 1.000 H39 H -5.59400 -3.26100 1.59800 1.000 H40 H -7.94900 -2.80500 0.76500 1.000 H41 H -6.89700 -1.36800 0.78500 1.000 H42 H -6.46500 -1.37500 -2.81100 1.000 H43 H -6.03000 -0.53400 -1.30200 1.000 H44 H -4.08900 -1.79900 -2.03200 1.000 H45 H -5.06800 -3.27700 -2.21800 1.000 H46 H -1.45700 -1.33500 1.37900 1.000 H47 H 0.64100 0.05500 1.16400 1.000 H48 H 0.84000 1.51400 -1.35800 1.000 H49 H 2.57900 2.83400 -0.11400 1.000 H50 H 2.81400 -0.20000 0.12400 1.000 H51 H 6.31600 0.77300 -2.05900 1.000 H52 H 7.65400 -1.09000 -2.95300 1.000 H53 H 7.88900 -3.17000 -1.65600 1.000 H54 H 6.78600 -3.38600 0.53600 1.000 H55 H 5.45500 -1.51800 1.43300 1.000 H56 H -0.19300 2.81700 1.20100 1.000 H57 H 0.33600 3.71000 -0.24500 1.000 H58 H -1.38000 2.53700 -1.59800 1.000 H59 H -1.90900 1.64400 -0.15200 1.000 H60 H -1.82900 4.91200 -1.82500 1.000 H61 H -3.29300 6.79100 -1.20000 1.000 H62 H -4.66000 6.66000 0.84400 1.000 H63 H -4.56300 4.65000 2.26300 1.000 H64 H -3.10500 2.76800 1.63400 1.000 H65 H -0.78600 -3.62600 0.59200 1.000 H66 H -0.04900 -2.87800 -0.84500 1.000 H67 H 1.39100 -1.49000 0.67700 1.000 H68 H 1.50400 -2.06300 3.05700 1.000 H69 H -0.16500 -1.60400 2.64300 1.000 H70 H 0.26300 -3.32000 2.84200 1.000 H71 H 2.22100 -3.62300 -0.27700 1.000 H72 H 2.87900 -3.35400 1.35500 1.000 H73 H 1.54600 -4.50800 1.11200 1.000 H74 H 2.21600 1.87600 1.34100 1.000 H75 H 3.17700 0.75900 -1.33200 1.000