# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'JOP' 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 2.93400 -0.02200 -1.44900 1.000 C1 C 2.38400 1.21900 1.12300 1.000 C2 C 3.97600 -0.52800 0.66300 1.000 C3 C -5.46600 -0.03400 0.06600 1.000 C4 C -4.14200 0.61500 -0.34100 1.000 O5 O -3.94700 1.81300 0.41300 1.000 C6 C -2.99200 -0.35600 -0.06300 1.000 N7 N -1.72400 0.26600 -0.45200 1.000 C8 C -0.56700 -0.40900 -0.29700 1.000 S9 S -0.58000 -1.99100 0.35600 1.000 N10 N 0.60000 0.16200 -0.65500 1.000 C11 C 1.85700 -0.57100 -0.48600 1.000 C12 C 4.06800 0.50400 -0.51700 1.000 C13 C 3.45900 1.77000 0.16000 1.000 C14 C 2.44000 -0.32700 0.93900 1.000 H15 H 3.31000 -0.81700 -2.09300 1.000 H16 H 2.52800 0.79300 -2.04900 1.000 H17 H 2.62200 1.48800 2.15200 1.000 H18 H 1.39900 1.59900 0.84900 1.000 H19 H 4.20200 -1.54300 0.33600 1.000 H20 H 4.58900 -0.23100 1.51400 1.000 H21 H -6.28600 0.65800 -0.13200 1.000 H22 H -5.61500 -0.94800 -0.50900 1.000 H23 H -5.44200 -0.27300 1.12900 1.000 H24 H -4.16600 0.85400 -1.40400 1.000 H25 H -3.91500 1.67500 1.36900 1.000 H26 H -2.96800 -0.59500 1.00000 1.000 H27 H -3.14100 -1.27000 -0.63800 1.000 H28 H -1.71600 1.16200 -0.82300 1.000 H29 H 0.60700 1.05900 -1.02600 1.000 H30 H 1.70100 -1.63600 -0.65800 1.000 H31 H 5.04900 0.62200 -0.97800 1.000 H32 H 3.00300 2.42000 -0.58800 1.000 H33 H 4.22700 2.30900 0.71500 1.000 H34 H 2.01400 -0.91900 1.74900 1.000