# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CB6' 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 -2.46100 -0.66800 -0.65900 1.000 C1 C -3.87200 -0.39300 -0.44100 1.000 C2 C -4.96300 -0.56000 -1.32200 1.000 C3 C -6.22500 -0.24100 -0.92600 1.000 C4 C -6.46100 0.25100 0.35100 1.000 C5 C -5.41800 0.42300 1.23000 1.000 C6 C -4.11300 0.10200 0.84300 1.000 S7 S -2.59800 0.21200 1.73000 1.000 C8 C -1.68000 -0.40500 0.37000 1.000 C9 C -0.18700 -0.60900 0.37700 1.000 O10 O 0.45900 0.58300 -0.07400 1.000 C11 C 1.81500 0.56700 -0.12800 1.000 C12 C 2.42800 -0.52500 0.23100 1.000 C13 C 3.92000 -0.68600 0.23300 1.000 C14 C 4.27600 -2.03900 -0.32800 1.000 O15 O 4.55400 -2.15300 -1.49800 1.000 O16 O 4.28600 -3.11600 0.47200 1.000 O17 O 4.40500 -0.58600 1.57300 1.000 C18 C 4.56900 0.40500 -0.62100 1.000 C19 C 3.99200 1.76100 -0.19800 1.000 O20 O 4.70200 2.81200 -0.85700 1.000 C21 C 2.51600 1.80500 -0.60400 1.000 O22 O 1.90000 2.95300 -0.01700 1.000 C23 C -7.37600 -0.42400 -1.88000 1.000 H24 H -2.08200 -1.06000 -1.59100 1.000 H25 H -4.79400 -0.94200 -2.31800 1.000 H26 H -7.46800 0.50100 0.65400 1.000 H27 H -7.78700 -1.42800 -1.76600 1.000 H28 H -8.14900 0.31200 -1.66300 1.000 H29 H -7.02400 -0.29100 -2.90400 1.000 H30 H -5.60800 0.80600 2.22200 1.000 H31 H 0.14400 -0.84200 1.38900 1.000 H32 H 0.07000 -1.43500 -0.28800 1.000 H33 H 1.82600 -1.36400 0.54600 1.000 H34 H 2.43800 1.87000 -1.68900 1.000 H35 H 4.04400 -1.25300 2.17300 1.000 H36 H 5.64800 0.40000 -0.46400 1.000 H37 H 4.34900 0.22600 -1.67400 1.000 H38 H 4.52100 -3.96200 0.06700 1.000 H39 H 4.08600 1.87800 0.88200 1.000 H40 H 4.38800 3.69900 -0.63400 1.000 H41 H 0.96300 3.05200 -0.23700 1.000