# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0E7' 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 3.82700 -0.29500 -0.19400 1.000 O1 O 4.01600 -0.54700 0.97700 1.000 C2 C 4.99700 -0.17200 -1.13600 1.000 C3 C 6.29800 -0.40800 -0.36700 1.000 C4 C 7.48600 -0.28300 -1.32400 1.000 N5 N 8.73200 -0.50800 -0.58700 1.000 C6 C 9.93900 -0.44600 -1.24200 1.000 N7 N 9.97400 -0.18700 -2.51900 1.000 N8 N 11.10800 -0.65800 -0.55100 1.000 N9 N 2.57100 -0.13100 -0.65400 1.000 C10 C 1.43300 -0.25700 0.26000 1.000 C11 C 0.20200 -0.64200 -0.51900 1.000 O12 O 0.26900 -0.79700 -1.72000 1.000 C13 C 1.19400 1.08100 0.96300 1.000 C14 C 2.37600 1.40700 1.83900 1.000 C15 C 3.43700 2.13000 1.32700 1.000 C16 C 2.39600 0.98900 3.15600 1.000 C17 C 4.52100 2.42900 2.13100 1.000 C18 C 3.48000 1.28800 3.96000 1.000 C19 C 4.54400 2.00600 3.44700 1.000 N20 N -0.97200 -0.81500 0.11900 1.000 C21 C -2.16900 -1.19000 -0.63900 1.000 C22 C -2.20700 -2.71000 -0.81200 1.000 C23 C -2.10700 -3.38300 0.55800 1.000 O24 O -1.10900 -3.12400 -1.62800 1.000 C25 C -3.39800 -0.73900 0.10800 1.000 O26 O -3.34500 -0.54900 1.30400 1.000 N27 N -4.55600 -0.54700 -0.55400 1.000 C28 C -5.77600 -0.21500 0.18500 1.000 C29 C -6.43100 -1.48400 0.66800 1.000 C30 C -6.74000 0.53800 -0.73300 1.000 C31 C -6.13500 1.86400 -1.11800 1.000 C32 C -5.34700 1.96200 -2.24900 1.000 C33 C -6.37300 2.98300 -0.34200 1.000 C34 C -4.79200 3.17700 -2.60200 1.000 C35 C -5.81800 4.19900 -0.69500 1.000 C36 C -5.02500 4.29600 -1.82300 1.000 O37 O -5.92900 -2.55500 0.42000 1.000 C38 C -8.14500 -2.68600 1.80600 1.000 O39 O -7.57100 -1.42400 1.37400 1.000 H40 H 4.90400 -0.91400 -1.92900 1.000 H41 H 5.00800 0.82700 -1.57200 1.000 H42 H 6.39100 0.33400 0.42600 1.000 H43 H 6.28600 -1.40600 0.06900 1.000 H44 H 7.39300 -1.02500 -2.11700 1.000 H45 H 7.49700 0.71600 -1.76000 1.000 H46 H 8.70500 -0.70200 0.36300 1.000 H47 H 10.82600 -0.14300 -2.98200 1.000 H48 H 11.08200 -0.85200 0.39900 1.000 H49 H 11.96000 -0.61400 -1.01400 1.000 H50 H 2.42000 0.07000 -1.59100 1.000 H51 H 1.64800 -1.02400 1.00400 1.000 H52 H 1.06700 1.86600 0.21700 1.000 H53 H 0.29500 1.01400 1.57600 1.000 H54 H 3.42000 2.46000 0.29900 1.000 H55 H 1.56400 0.42800 3.55800 1.000 H56 H 5.35100 2.99300 1.73100 1.000 H57 H 3.49600 0.96100 4.98900 1.000 H58 H 5.39100 2.23900 4.07400 1.000 H59 H -1.02500 -0.69200 1.07900 1.000 H60 H -2.14300 -0.71300 -1.61800 1.000 H61 H -3.14300 -2.99700 -1.29100 1.000 H62 H -2.94500 -3.06700 1.18000 1.000 H63 H -2.13400 -4.46500 0.43400 1.000 H64 H -1.17100 -3.09500 1.03700 1.000 H65 H -1.15400 -2.80600 -2.53900 1.000 H66 H -4.58100 -0.62700 -1.52100 1.000 H67 H -5.52400 0.41200 1.04000 1.000 H68 H -6.92300 -0.05200 -1.63100 1.000 H69 H -7.68200 0.70700 -0.21100 1.000 H70 H -5.16400 1.08800 -2.85700 1.000 H71 H -6.99300 2.90800 0.53900 1.000 H72 H -4.17500 3.25400 -3.48500 1.000 H73 H -6.00400 5.07400 -0.08900 1.000 H74 H -4.59100 5.24600 -2.09900 1.000 H75 H -8.37200 -3.30000 0.93500 1.000 H76 H -7.43300 -3.21000 2.44400 1.000 H77 H -9.06200 -2.49500 2.36500 1.000