# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '233' 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 0.35900 0.16000 -3.16200 1.000 C1 C 1.46100 -0.06100 -4.20100 1.000 C2 C 1.06300 0.63300 -5.50800 1.000 C3 C -0.32800 0.14000 -5.91900 1.000 C4 C -1.29500 0.34500 -4.75100 1.000 C5 C -2.69500 -0.11300 -5.16500 1.000 O6 O 2.68900 0.49100 -3.72000 1.000 O7 O 2.00700 0.31400 -6.53100 1.000 O8 O -0.26600 -1.24800 -6.25100 1.000 O9 O -0.86100 -0.41400 -3.62500 1.000 O10 O -3.60200 0.08300 -4.07800 1.000 N11 N 0.74600 -0.47100 -1.89900 1.000 O12 O -0.38500 1.03000 -0.72200 1.000 C13 C 0.31900 0.04300 -0.72900 1.000 C14 C 0.71800 -0.60700 0.57000 1.000 C15 C 0.10400 0.16800 1.73800 1.000 C16 C 0.50900 -0.49100 3.05700 1.000 C17 C -0.10400 0.28400 4.22500 1.000 C18 C 0.30000 -0.37500 5.54400 1.000 N19 N -0.28700 0.36700 6.66200 1.000 C20 C -0.06400 -0.03400 7.92900 1.000 O21 O 0.62300 -1.01200 8.14500 1.000 O22 O -0.60400 0.64800 8.95700 1.000 C23 C -0.36400 0.21500 10.32200 1.000 H24 H 0.22000 1.22900 -3.00400 1.000 H25 H 1.58700 -1.12900 -4.37900 1.000 H26 H 1.03900 1.71300 -5.35600 1.000 H27 H -0.67500 0.70700 -6.78400 1.000 H28 H -1.32400 1.40200 -4.48600 1.000 H29 H -3.02800 0.46600 -6.02600 1.000 H30 H -2.66700 -1.17100 -5.42800 1.000 H31 H 2.90200 0.02600 -2.89900 1.000 H32 H 2.86600 0.64100 -6.23100 1.000 H33 H 0.35200 -1.33100 -6.98900 1.000 H34 H -4.46900 -0.21800 -4.38000 1.000 H35 H 1.31000 -1.26100 -1.90400 1.000 H36 H 1.80400 -0.60100 0.66100 1.000 H37 H 0.35700 -1.63500 0.58800 1.000 H38 H -0.98100 0.16300 1.64700 1.000 H39 H 0.46500 1.19700 1.72000 1.000 H40 H 1.59500 -0.48600 3.14800 1.000 H41 H 0.14800 -1.51900 3.07500 1.000 H42 H -1.19000 0.27900 4.13400 1.000 H43 H 0.25600 1.31200 4.20700 1.000 H44 H 1.38600 -0.37000 5.63500 1.000 H45 H -0.06000 -1.40300 5.56200 1.000 H46 H -0.83600 1.14800 6.49000 1.000 H47 H -0.87800 0.88500 11.01100 1.000 H48 H -0.74100 -0.79800 10.45300 1.000 H49 H 0.70600 0.23400 10.52600 1.000