# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9RB' 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 -4.91700 -0.88500 -0.00300 1.000 C1 C -3.85000 -0.00600 -0.00100 1.000 C2 C -0.30400 0.25600 0.00600 1.000 C3 C 0.07900 -1.09000 0.00300 1.000 C4 C 1.40300 -1.42300 0.00100 1.000 C5 C 2.37700 -0.41800 0.00200 1.000 C6 C 3.80300 -0.77600 -0.00000 1.000 C7 C 4.74200 0.19300 0.00100 1.000 C8 C 6.16200 -0.16300 -0.00200 1.000 C9 C 1.99300 0.92900 0.00500 1.000 C10 C 0.66900 1.26100 0.00700 1.000 C11 C -4.38700 1.30200 -0.00300 1.000 C12 C -4.83400 -2.38900 -0.00100 1.000 C13 C -3.59500 2.58400 -0.00400 1.000 O14 O 6.49600 -1.33400 -0.00500 1.000 N15 N 7.10000 0.80500 -0.00100 1.000 O16 O 8.47300 0.46000 -0.00300 1.000 N17 N -1.62900 0.58800 0.00300 1.000 N18 N -2.52700 -0.33800 0.00200 1.000 N19 N -5.68800 1.20500 -0.00600 1.000 N20 N -6.04300 -0.14900 0.00100 1.000 C21 C -7.41000 -0.67600 0.00000 1.000 H22 H -0.67300 -1.86500 0.00200 1.000 H23 H 1.69800 -2.46200 -0.00000 1.000 H24 H 4.09900 -1.81400 -0.00300 1.000 H25 H 4.44600 1.23200 0.00300 1.000 H26 H 2.74400 1.70500 0.00600 1.000 H27 H 0.37300 2.29900 0.00900 1.000 H28 H -4.81600 -2.75100 1.02700 1.000 H29 H -5.70200 -2.80200 -0.51600 1.000 H30 H -3.92400 -2.70400 -0.51300 1.000 H31 H -3.40300 2.89200 -1.03100 1.000 H32 H -4.16300 3.36100 0.50900 1.000 H33 H -2.64800 2.42600 0.51200 1.000 H34 H 6.83400 1.73800 0.00100 1.000 H35 H 9.07000 1.22100 -0.00300 1.000 H36 H -7.74700 -0.81200 -1.02700 1.000 H37 H -7.43000 -1.63500 0.51900 1.000 H38 H -8.07000 0.02600 0.50900 1.000