# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C8B' 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 -1.69900 -0.18800 -1.01800 1.000 C1 C -2.42400 -1.27400 -0.28100 1.000 C2 C -2.99300 -0.70300 1.02000 1.000 C3 C -3.86400 0.48700 0.70800 1.000 C4 C -5.22600 0.32100 0.54100 1.000 C5 C -6.02500 1.41200 0.25400 1.000 C6 C 0.92500 -0.30900 1.04700 1.000 C7 C 1.75500 0.91100 0.74200 1.000 C8 C 3.15600 0.92600 0.31300 1.000 C9 C 0.49800 -0.97600 -0.26200 1.000 O10 O -3.50000 -1.75200 -1.09100 1.000 O11 O 4.60600 -2.35200 0.11400 1.000 C12 C 0.24600 1.02800 -1.75500 1.000 O13 O 0.46400 -3.23800 0.32500 1.000 C14 C -4.10200 2.83600 0.31300 1.000 C15 C -3.30200 1.74400 0.59400 1.000 C16 C -0.20400 -2.26400 0.04900 1.000 C17 C 4.10600 -0.06600 0.06500 1.000 C18 C 5.36500 0.28400 -0.33500 1.000 C19 C 5.70700 1.62000 -0.49500 1.000 C20 C -2.12500 -3.68600 0.35300 1.000 N21 N 3.75100 -1.49300 0.23500 1.000 O22 O 2.60400 -1.80900 0.49400 1.000 C23 C 4.78600 2.61500 -0.25500 1.000 C24 C 3.49800 2.28100 0.15100 1.000 N25 N 2.37900 3.02200 0.46200 1.000 C26 C 1.35000 2.18900 0.80600 1.000 N27 N -0.36800 -0.06700 -1.00000 1.000 O28 O -2.34700 0.61000 -1.66100 1.000 N29 N -1.53500 -2.38300 0.03600 1.000 C30 C -5.46200 2.66900 0.13400 1.000 H31 H -3.58700 -1.46600 1.52300 1.000 H32 H -2.17400 -0.39300 1.66900 1.000 H33 H -5.66600 -0.66100 0.63500 1.000 H34 H -7.08900 1.28300 0.12400 1.000 H35 H 1.51400 -1.01100 1.63700 1.000 H36 H 0.03900 -0.01400 1.61100 1.000 H37 H 1.38400 -1.18800 -0.86000 1.000 H38 H -3.21900 -2.11800 -1.94100 1.000 H39 H -0.53500 1.66300 -2.17400 1.000 H40 H 0.87800 1.61800 -1.09100 1.000 H41 H 0.85100 0.61700 -2.56300 1.000 H42 H -3.66100 3.81800 0.21900 1.000 H43 H -2.23900 1.87500 0.73400 1.000 H44 H 6.09900 -0.48400 -0.52600 1.000 H45 H 6.70600 1.88200 -0.81200 1.000 H46 H -2.23900 -4.26600 -0.56300 1.000 H47 H -1.47400 -4.22100 1.04400 1.000 H48 H -3.10200 -3.53900 0.81400 1.000 H49 H 5.06200 3.65200 -0.38300 1.000 H50 H 2.32800 3.99000 0.43600 1.000 H51 H 0.35900 2.51200 1.08900 1.000 H52 H -6.08700 3.52200 -0.08500 1.000