# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9MU' 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 -1.02500 2.20800 0.38000 1.000 C1 C 0.04500 1.22900 0.58600 1.000 C2 C 1.37400 1.86200 0.26500 1.000 O3 O 1.42200 3.01800 -0.10000 1.000 C4 C 0.03900 0.76600 2.04500 1.000 C5 C -1.25300 0.04900 2.33900 1.000 C6 C -1.37900 -1.29600 2.04700 1.000 C7 C -2.31000 0.73500 2.90800 1.000 C8 C -2.56400 -1.95400 2.31700 1.000 C9 C -3.49500 0.07700 3.17800 1.000 C10 C -3.62300 -1.26700 2.88100 1.000 S11 S -1.86000 2.23300 -1.05000 1.000 O12 O -2.84200 3.25200 -0.92300 1.000 O13 O -0.88500 2.21800 -2.08400 1.000 C14 C -4.02900 0.64500 -0.74800 1.000 C15 C -2.73700 0.71000 -1.17000 1.000 C16 C -2.09600 -0.41100 -1.69500 1.000 C17 C -2.74400 -1.60300 -1.80100 1.000 C18 C -4.77900 -2.92400 -1.46400 1.000 C19 C -6.06800 -2.99300 -1.03100 1.000 C20 C -6.70700 -1.87300 -0.50100 1.000 C21 C -6.06400 -0.67700 -0.41100 1.000 C22 C -4.72900 -0.57000 -0.83700 1.000 C23 C -4.08000 -1.70900 -1.37700 1.000 N24 N 2.50900 1.14500 0.38400 1.000 C25 C 3.80100 1.76100 0.07100 1.000 C26 C 4.91800 0.73800 0.28700 1.000 C27 C 4.76300 -0.40800 -0.71800 1.000 C28 C 6.27600 1.41400 0.07800 1.000 N29 N 5.91400 -1.31200 -0.58500 1.000 C30 C 7.39500 0.40000 0.32500 1.000 C31 C 7.26800 -0.75000 -0.67900 1.000 C32 C 5.72700 -2.65800 -0.37700 1.000 N33 N 6.80800 -3.47400 -0.14100 1.000 N34 N 4.52400 -3.16100 -0.40300 1.000 H35 H -1.24800 2.83800 1.08300 1.000 H36 H -0.11600 0.37100 -0.06700 1.000 H37 H 0.87700 0.09000 2.21500 1.000 H38 H 0.13200 1.63200 2.70100 1.000 H39 H -0.55100 -1.83300 1.60700 1.000 H40 H -2.21000 1.78500 3.14100 1.000 H41 H -2.66300 -3.00500 2.08800 1.000 H42 H -4.32100 0.61300 3.62200 1.000 H43 H -4.54900 -1.78100 3.09200 1.000 H44 H -4.51300 1.52200 -0.34400 1.000 H45 H -1.07000 -0.33300 -2.02200 1.000 H46 H -2.23500 -2.46300 -2.21100 1.000 H47 H -4.29700 -3.80000 -1.87300 1.000 H48 H -6.60300 -3.92800 -1.10000 1.000 H49 H -7.73000 -1.95400 -0.16500 1.000 H50 H -6.57200 0.18200 0.00200 1.000 H51 H 2.47000 0.22100 0.67500 1.000 H52 H 3.80500 2.09000 -0.96800 1.000 H53 H 3.96200 2.61800 0.72500 1.000 H54 H 4.86000 0.34400 1.30100 1.000 H55 H 3.84300 -0.95400 -0.50900 1.000 H56 H 4.73000 -0.00500 -1.73000 1.000 H57 H 6.34200 1.78700 -0.94500 1.000 H58 H 6.37800 2.24600 0.77500 1.000 H59 H 8.36200 0.88800 0.19900 1.000 H60 H 7.31400 0.00900 1.33900 1.000 H61 H 8.00100 -1.52200 -0.44500 1.000 H62 H 7.43900 -0.37500 -1.68800 1.000 H63 H 7.69200 -3.08900 -0.03800 1.000 H64 H 6.68600 -4.43400 -0.07800 1.000 H65 H 4.39200 -4.11000 -0.25600 1.000