# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9MC' 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 -5.48200 -0.81300 -1.49300 1.000 C1 C 2.87400 -1.85100 -0.41500 1.000 C2 C 7.28800 0.36500 -0.88800 1.000 C3 C 5.76200 0.25000 -0.85800 1.000 C4 C 3.50800 -0.91700 0.38500 1.000 C5 C -0.73900 -0.99300 0.17700 1.000 C6 C -1.49200 -0.08400 0.91800 1.000 C7 C -3.68500 0.87000 1.64500 1.000 C8 C -2.87000 -0.11100 0.84400 1.000 N9 N -2.84300 2.96600 -0.91100 1.000 C10 C -6.89100 -1.45600 -1.50900 1.000 C11 C -3.50300 -1.03800 0.03600 1.000 C12 C -2.76100 -1.94200 -0.70200 1.000 C13 C 0.74300 -0.96900 0.25200 1.000 O14 O 5.65800 -2.21400 0.15900 1.000 S15 S 5.26700 -0.88400 0.46900 1.000 O16 O 5.54700 -0.31500 1.74100 1.000 O17 O 7.67700 1.25900 -1.93300 1.000 C18 C 2.76600 -0.00900 1.11800 1.000 C19 C 1.38700 -0.03100 1.05600 1.000 C20 C 1.49500 -1.87700 -0.48900 1.000 C21 C -1.38300 -1.92800 -0.63200 1.000 C22 C -5.00800 -1.06300 -0.04000 1.000 C23 C -5.54300 -2.47000 0.29600 1.000 C24 C -6.74000 -2.72100 -0.63800 1.000 C25 C -3.46400 2.36000 1.37400 1.000 C26 C -2.94500 1.73300 2.67000 1.000 C27 C -2.44800 2.73300 0.32500 1.000 C28 C -1.11300 2.82600 0.67000 1.000 C29 C -0.18600 3.16900 -0.30200 1.000 C30 C -0.63900 3.40700 -1.59100 1.000 C31 C -1.99000 3.29500 -1.86100 1.000 H32 H -4.82300 -1.31100 -2.20500 1.000 H33 H -5.53900 0.25500 -1.70300 1.000 H34 H 3.45800 -2.55700 -0.98600 1.000 H35 H 7.64200 0.74800 0.06900 1.000 H36 H 7.72200 -0.61800 -1.06900 1.000 H37 H 5.32700 1.23400 -0.67700 1.000 H38 H 5.40800 -0.13300 -1.81500 1.000 H39 H -0.99800 0.63900 1.54900 1.000 H40 H -4.69600 0.54900 1.89500 1.000 H41 H -7.62400 -0.77800 -1.07200 1.000 H42 H -7.17700 -1.72300 -2.52600 1.000 H43 H -3.26100 -2.66600 -1.32800 1.000 H44 H 8.63400 1.38000 -2.01100 1.000 H45 H 3.26600 0.71800 1.74100 1.000 H46 H 0.80800 0.67900 1.62900 1.000 H47 H 1.00100 -2.60700 -1.11400 1.000 H48 H -0.80400 -2.63400 -1.20800 1.000 H49 H -5.43600 -0.32000 0.63300 1.000 H50 H -4.76800 -3.21600 0.11800 1.000 H51 H -5.86500 -2.50900 1.33600 1.000 H52 H -7.64400 -2.88000 -0.05100 1.000 H53 H -6.54600 -3.58800 -1.26900 1.000 H54 H -4.33000 3.01800 1.44500 1.000 H55 H -3.47000 1.97900 3.59300 1.000 H56 H -1.86900 1.59100 2.76400 1.000 H57 H -0.79600 2.63400 1.68500 1.000 H58 H 0.86300 3.25000 -0.06200 1.000 H59 H 0.05500 3.67700 -2.37300 1.000 H60 H -2.35100 3.47800 -2.86300 1.000