# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '083' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -1.05300 0.41900 1.63500 1.000 C1 C -1.59400 0.23700 0.38600 1.000 C2 C -3.03200 0.50800 0.15500 1.000 N3 N -3.78200 0.92700 1.16500 1.000 C4 C -5.06700 1.17800 0.99300 1.000 C5 C -5.91300 1.65300 2.14700 1.000 C6 C -5.63000 0.99900 -0.26300 1.000 N7 N -3.53600 0.33300 -1.05900 1.000 C8 C -4.81600 0.56100 -1.29800 1.000 C9 C -5.38200 0.35200 -2.67900 1.000 N10 N -0.83600 -0.17800 -0.60300 1.000 C11 C 0.45600 -0.53100 -0.36900 1.000 C12 C 0.81000 -1.93000 -0.13400 1.000 C13 C -0.14700 -2.94900 -0.14100 1.000 C14 C 0.24200 -4.23800 0.08400 1.000 C15 C 1.57700 -4.55400 0.31900 1.000 C16 C 2.53600 -3.58500 0.33300 1.000 C17 C 2.17000 -2.25000 0.10500 1.000 C18 C 3.11200 -1.20500 0.10500 1.000 C19 C 2.68600 0.08900 -0.12500 1.000 N20 N 1.40900 0.38900 -0.35500 1.000 C21 C 3.68800 1.18200 -0.12200 1.000 N22 N 4.96600 0.90300 0.10100 1.000 C23 C 5.88700 1.84500 0.11200 1.000 C24 C 5.55200 3.16800 -0.11100 1.000 C25 C 4.22700 3.50400 -0.34800 1.000 C26 C 3.28100 2.49400 -0.35900 1.000 H27 H -1.59200 0.79700 2.34700 1.000 H28 H -0.13200 0.16600 1.80600 1.000 H29 H -5.89400 2.74300 2.18600 1.000 H30 H -6.93900 1.31200 2.01000 1.000 H31 H -5.51600 1.24900 3.07800 1.000 H32 H -6.67800 1.19700 -0.43200 1.000 H33 H -5.29700 1.27700 -3.25000 1.000 H34 H -4.82800 -0.43900 -3.18300 1.000 H35 H -6.43200 0.06900 -2.60200 1.000 H36 H -1.18600 -2.71800 -0.32200 1.000 H37 H -0.49800 -5.02500 0.07900 1.000 H38 H 1.85800 -5.58200 0.49400 1.000 H39 H 3.56900 -3.84300 0.51600 1.000 H40 H 4.15600 -1.41200 0.28500 1.000 H41 H 2.24100 2.71900 -0.54400 1.000 H42 H 6.91800 1.58000 0.29700 1.000 H43 H 6.31500 3.93300 -0.09900 1.000 H44 H 3.94100 4.53100 -0.52300 1.000