# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '5QT' 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 -2.06800 -0.14300 -0.00400 1.000 C1 C -4.61900 -1.14700 0.00400 1.000 C2 C -3.24400 0.74000 -0.00200 1.000 C3 C 6.51400 0.61000 0.00300 1.000 C4 C 5.27700 -0.29200 0.00100 1.000 C5 C 5.29100 -1.17200 -1.25100 1.000 C6 C 5.29000 -1.17800 1.24800 1.000 C7 C 4.01500 0.57300 0.00200 1.000 O8 O 2.84200 -0.28200 -0.00100 1.000 C9 C 1.64500 0.32500 -0.00000 1.000 O10 O 1.58000 1.53200 0.00200 1.000 C11 C 0.38300 -0.49800 -0.00300 1.000 N12 N -0.78100 0.39200 -0.00200 1.000 N13 N -2.24900 -1.43900 -0.00100 1.000 N14 N -3.54800 -1.96000 0.00200 1.000 O15 O -5.73600 -1.62900 0.00200 1.000 N16 N -4.47600 0.19100 -0.00400 1.000 S17 S -3.05100 2.44100 0.00200 1.000 H18 H 6.50500 1.24100 -0.88500 1.000 H19 H 6.50400 1.23700 0.89500 1.000 H20 H 7.41300 -0.00600 0.00200 1.000 H21 H 6.19000 -1.78800 -1.25200 1.000 H22 H 4.41100 -1.81400 -1.25300 1.000 H23 H 5.28200 -0.54100 -2.13900 1.000 H24 H 6.18900 -1.79400 1.24700 1.000 H25 H 5.28000 -0.55000 2.13900 1.000 H26 H 4.40900 -1.82000 1.24600 1.000 H27 H 4.00600 1.20100 0.89300 1.000 H28 H 4.00700 1.20500 -0.88700 1.000 H29 H 0.36000 -1.12500 -0.89400 1.000 H30 H 0.35900 -1.12900 0.88600 1.000 H31 H -0.65500 1.35400 0.00100 1.000 H32 H -3.67800 -2.92100 0.00500 1.000 H33 H -5.26100 0.76200 -0.00300 1.000