# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0YS' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -0.43700 4.47600 0.01100 1.000 C1 C 0.68000 4.06100 0.21000 1.000 O2 O 1.66600 4.91400 0.52700 1.000 C3 C 0.96400 2.58400 0.11000 1.000 N4 N -0.26800 1.87200 -0.23900 1.000 C5 C -1.13300 1.50800 0.72800 1.000 C6 C -2.37400 0.79100 0.37600 1.000 C7 C -2.65100 0.48300 -0.95900 1.000 C8 C -3.80800 -0.19200 -1.28300 1.000 Cl9 Cl -4.15200 -0.57500 -2.94100 1.000 C10 C -4.70000 -0.56600 -0.28400 1.000 O11 O -5.83800 -1.23100 -0.60700 1.000 C12 C -4.42700 -0.26200 1.04500 1.000 Cl13 Cl -5.54400 -0.73300 2.28800 1.000 C14 C -3.27300 0.41300 1.37700 1.000 O15 O -0.89200 1.77100 1.89000 1.000 C16 C 2.01800 2.34000 -0.97100 1.000 C17 C 2.39800 0.85800 -0.98800 1.000 C18 C 3.37100 0.55700 -2.15600 1.000 C19 C 4.10700 -0.71400 -1.67300 1.000 N20 N 3.19300 0.50700 0.21600 1.000 C21 C 3.94900 -0.71300 -0.14100 1.000 C22 C 5.30500 -0.68800 0.51600 1.000 O23 O 5.94400 0.47900 0.69000 1.000 O24 O 5.81700 -1.71800 0.88400 1.000 C25 C 3.17300 -1.95500 0.30400 1.000 O26 O 3.14600 -2.01300 1.73200 1.000 C27 C 1.74200 -1.88100 -0.23100 1.000 N28 N 1.76100 -1.97700 -1.69600 1.000 C29 C 0.93400 -3.01900 0.33700 1.000 O30 O 0.43800 -2.93500 1.58200 1.000 O31 O 0.73300 -4.00800 -0.32800 1.000 H32 H 1.43400 5.85100 0.58400 1.000 H33 H 1.33500 2.22000 1.06800 1.000 H34 H -0.46000 1.66300 -1.16600 1.000 H35 H -1.95900 0.77400 -1.73500 1.000 H36 H -5.74400 -2.19300 -0.61100 1.000 H37 H -3.06000 0.64600 2.41000 1.000 H38 H 1.61400 2.62300 -1.94300 1.000 H39 H 2.90300 2.94000 -0.75800 1.000 H40 H 1.50700 0.23500 -1.05900 1.000 H41 H 2.82100 0.35700 -3.07500 1.000 H42 H 4.07100 1.38000 -2.29700 1.000 H43 H 3.64500 -1.60500 -2.10000 1.000 H44 H 5.16100 -0.66800 -1.94600 1.000 H45 H 2.59300 0.34200 1.01000 1.000 H46 H 6.81200 0.44500 1.11600 1.000 H47 H 3.66200 -2.84800 -0.08700 1.000 H48 H 2.71300 -1.25600 2.14800 1.000 H49 H 1.29200 -0.93300 0.06500 1.000 H50 H 2.05700 -2.89500 -1.99500 1.000 H51 H 0.86000 -1.74300 -2.08600 1.000 H52 H -0.07400 -3.69000 1.90200 1.000