# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0NR' 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 -4.26400 1.99600 -1.09000 1.000 C1 C -4.69200 2.95300 -2.01400 1.000 C2 C -5.47600 2.52900 -3.07100 1.000 C3 C -5.80600 1.18600 -3.17800 1.000 N4 N -5.39200 0.30100 -2.29600 1.000 C5 C -4.63700 0.64900 -1.26200 1.000 N6 N -4.21300 -0.28900 -0.35100 1.000 C7 C -4.58700 -1.62500 -0.52700 1.000 C8 C -3.43500 0.04900 0.72000 1.000 C9 C -3.03500 1.32400 0.95300 1.000 C10 C -2.17800 1.64100 2.15100 1.000 C11 C -0.72700 1.64900 1.74200 1.000 C12 C -3.42200 2.36000 0.06000 1.000 O13 O -3.07600 3.51400 0.24600 1.000 C14 C -5.73900 -2.11100 0.08000 1.000 C15 C -6.10500 -3.43100 -0.09500 1.000 C16 C -5.32800 -4.26800 -0.87400 1.000 C17 C -4.18200 -3.78800 -1.48000 1.000 C18 C -3.81200 -2.46800 -1.31300 1.000 C19 C -3.01400 -1.01500 1.66100 1.000 O20 O -2.12300 -1.78000 1.35400 1.000 O21 O -3.62100 -1.13400 2.85800 1.000 C22 C -3.15700 -2.19900 3.72900 1.000 C23 C -0.14200 2.82200 1.30200 1.000 C24 C 1.18600 2.83600 0.92700 1.000 C25 C 1.93900 1.66300 0.99200 1.000 C26 C 1.34200 0.48200 1.43700 1.000 C27 C 0.01500 0.48300 1.81400 1.000 C28 C 3.36200 1.67100 0.59100 1.000 O29 O 3.87800 2.70000 0.20300 1.000 N30 N 4.08600 0.53600 0.65500 1.000 C31 C 5.49600 0.54300 0.25800 1.000 C32 C 5.60000 0.35100 -1.25600 1.000 C33 C 4.96800 -0.98800 -1.64500 1.000 C34 C 5.70400 -2.12500 -0.93400 1.000 C35 C 5.60000 -1.93200 0.58000 1.000 C36 C 6.23200 -0.59400 0.96900 1.000 C37 C 7.17700 -2.11700 -1.34900 1.000 C38 C 7.80900 -0.77900 -0.96000 1.000 C39 C 7.70500 -0.58600 0.55400 1.000 C40 C 7.07300 0.35800 -1.67100 1.000 N41 N 9.22300 -0.77100 -1.35900 1.000 H42 H -4.42000 3.99300 -1.90500 1.000 H43 H -5.82800 3.23600 -3.80600 1.000 H44 H -6.41800 0.85800 -4.00500 1.000 H45 H -2.44900 2.62100 2.54400 1.000 H46 H -2.33400 0.88500 2.92000 1.000 H47 H -6.34600 -1.45800 0.69000 1.000 H48 H -7.00000 -3.80900 0.37700 1.000 H49 H -5.61700 -5.30000 -1.01000 1.000 H50 H -3.57700 -4.44400 -2.08800 1.000 H51 H -2.91900 -2.09200 -1.79000 1.000 H52 H -3.72700 -2.18300 4.65800 1.000 H53 H -3.29500 -3.16000 3.23400 1.000 H54 H -2.09900 -2.05300 3.95000 1.000 H55 H -0.72500 3.73000 1.25100 1.000 H56 H 1.64100 3.75300 0.58300 1.000 H57 H 1.91900 -0.42900 1.49000 1.000 H58 H -0.44800 -0.43000 2.15900 1.000 H59 H 3.67400 -0.28600 0.96500 1.000 H60 H 5.94600 1.49700 0.53500 1.000 H61 H 5.07600 1.16100 -1.76300 1.000 H62 H 3.91900 -0.99300 -1.34900 1.000 H63 H 5.04200 -1.12500 -2.72400 1.000 H64 H 5.25400 -3.07800 -1.21100 1.000 H65 H 4.55100 -1.93800 0.87600 1.000 H66 H 6.12400 -2.74200 1.08700 1.000 H67 H 6.15800 -0.45700 2.04700 1.000 H68 H 7.70100 -2.92700 -0.84200 1.000 H69 H 7.25100 -2.25400 -2.42800 1.000 H70 H 8.15500 0.36700 0.83100 1.000 H71 H 8.22900 -1.39600 1.06000 1.000 H72 H 7.14700 0.22100 -2.75000 1.000 H73 H 7.52300 1.31200 -1.39500 1.000 H74 H 9.31800 -0.89700 -2.35500 1.000 H75 H 9.67900 0.07600 -1.05600 1.000