# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0LU' 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 -0.90000 1.03500 0.63400 1.000 C1 C -1.04100 -0.43800 0.83900 1.000 C2 C -1.53900 1.72500 -0.37900 1.000 C3 C -0.06300 1.73100 1.50000 1.000 C4 C -2.36500 -1.01500 0.45800 1.000 C5 C 0.04300 -1.14300 0.02200 1.000 S6 S -2.65000 0.91100 -1.47500 1.000 C7 C -1.32300 3.09300 -0.53900 1.000 C8 C 0.14200 3.08600 1.34600 1.000 C9 C -3.14700 -0.51100 -0.56500 1.000 C10 C -2.82100 -2.11700 1.17400 1.000 C11 C 1.42100 -0.66100 0.48000 1.000 C12 C -0.48500 3.77100 0.32100 1.000 C13 C -4.36200 -1.11800 -0.88200 1.000 C14 C -4.02700 -2.71000 0.86500 1.000 C15 C 2.50700 -1.45500 -0.24900 1.000 O16 O 1.56400 0.72800 0.17900 1.000 C17 C -4.80000 -2.21300 -0.16900 1.000 N18 N 3.82600 -1.07700 0.27700 1.000 C19 C 4.87500 -1.98400 -0.22600 1.000 C20 C 4.17400 0.30600 -0.11100 1.000 C21 C 5.93100 -1.11100 -0.93600 1.000 C22 C 5.71100 0.28800 -0.30300 1.000 H23 H -0.86400 -0.65500 1.89200 1.000 H24 H 0.43100 1.20400 2.30300 1.000 H25 H -0.03300 -2.22000 0.17000 1.000 H26 H -0.09000 -0.91100 -1.03500 1.000 H27 H -1.81400 3.62400 -1.34100 1.000 H28 H 0.79400 3.61300 2.02700 1.000 H29 H -2.22300 -2.51300 1.98200 1.000 H30 H 1.52000 -0.81200 1.55500 1.000 H31 H -0.31900 4.83100 0.19500 1.000 H32 H -4.96200 -0.72800 -1.69100 1.000 H33 H -4.36900 -3.56300 1.43200 1.000 H34 H 2.34500 -2.52200 -0.09100 1.000 H35 H 2.46500 -1.23500 -1.31600 1.000 H36 H 1.48700 0.93700 -0.76200 1.000 H37 H -5.74200 -2.68100 -0.41500 1.000 H38 H 5.33300 -2.51800 0.60700 1.000 H39 H 4.44400 -2.69500 -0.93000 1.000 H40 H 3.67800 0.57600 -1.04300 1.000 H41 H 3.89800 1.00300 0.68100 1.000 H42 H 6.93700 -1.47600 -0.72500 1.000 H43 H 5.74900 -1.08400 -2.01000 1.000 H44 H 6.02900 1.07800 -0.98400 1.000 H45 H 6.22600 0.36900 0.65400 1.000