# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0LT' 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 -0.43800 1.09500 1.09300 1.000 N1 N 0.63800 1.63800 0.49000 1.000 C2 C 1.98500 1.19800 0.86200 1.000 C3 C -1.79700 1.48700 0.66900 1.000 C4 C 2.40100 0.02300 -0.02600 1.000 C5 C -2.76800 0.50900 0.43700 1.000 C6 C -4.03700 0.88100 0.04100 1.000 N7 N 2.48000 -2.36500 0.17400 1.000 C8 C 3.85100 -0.39900 0.28800 1.000 O9 O -0.29000 0.27900 1.98100 1.000 C10 C -4.34800 2.23000 -0.12600 1.000 C11 C -2.11700 2.83700 0.50600 1.000 C12 C 4.71400 -0.31300 -0.97300 1.000 C13 C 0.46100 2.66800 -0.53600 1.000 C14 C -3.38400 3.20100 0.10500 1.000 C15 C 1.54100 -1.21900 0.29200 1.000 C16 C 3.74700 -1.86100 0.77100 1.000 O17 O -4.98400 -0.06900 -0.18700 1.000 C18 C 6.14900 -0.61000 -0.62000 1.000 O19 O -5.59700 2.59400 -0.51500 1.000 C20 C -5.78400 -2.34700 -0.29800 1.000 O21 O -6.47800 -4.66100 -0.37500 1.000 C22 C -4.59600 -1.43100 0.00300 1.000 C23 C -5.36800 -3.80500 -0.09400 1.000 C24 C 1.01400 4.00000 -0.02300 1.000 C25 C 1.21200 2.25900 -1.80500 1.000 C26 C 6.99500 0.41700 -0.24400 1.000 C27 C 6.61700 -1.91000 -0.66700 1.000 C28 C -5.84800 3.99200 -0.66600 1.000 C29 C -6.19400 -6.05200 -0.21500 1.000 C30 C 8.31100 0.14500 0.07800 1.000 C31 C 7.93400 -2.18200 -0.34300 1.000 C32 C 8.78100 -1.15400 0.02600 1.000 H33 H 2.68700 2.02100 0.72600 1.000 H34 H 1.99000 0.88500 1.90600 1.000 H35 H 2.30400 0.29100 -1.07800 1.000 H36 H -2.52500 -0.53600 0.56600 1.000 H37 H 2.13600 -3.16800 0.67700 1.000 H38 H 4.26700 0.23100 1.07400 1.000 H39 H -1.37000 3.59500 0.69000 1.000 H40 H 4.36200 -1.04100 -1.70400 1.000 H41 H 4.64300 0.68900 -1.39400 1.000 H42 H -0.60000 2.77800 -0.76200 1.000 H43 H -3.62900 4.24500 -0.02600 1.000 H44 H 1.14500 -1.15600 1.30600 1.000 H45 H 0.73000 -1.31700 -0.42900 1.000 H46 H 3.69600 -1.89900 1.86000 1.000 H47 H 4.59500 -2.44300 0.41000 1.000 H48 H -6.60700 -2.10700 0.37500 1.000 H49 H -6.10300 -2.20100 -1.32900 1.000 H50 H -3.77200 -1.67100 -0.66900 1.000 H51 H -4.27600 -1.57700 1.03500 1.000 H52 H -4.54500 -4.04500 -0.76700 1.000 H53 H -5.04900 -3.95100 0.93700 1.000 H54 H 2.07500 3.89000 0.20200 1.000 H55 H 0.88200 4.76600 -0.78700 1.000 H56 H 0.47900 4.29100 0.88100 1.000 H57 H 0.81900 1.31100 -2.17000 1.000 H58 H 1.08100 3.02600 -2.56800 1.000 H59 H 2.27300 2.14900 -1.57900 1.000 H60 H 6.62700 1.43200 -0.20400 1.000 H61 H 5.95600 -2.71200 -0.95600 1.000 H62 H -5.67900 4.49700 0.28500 1.000 H63 H -5.17500 4.40200 -1.42000 1.000 H64 H -6.88100 4.14500 -0.98000 1.000 H65 H -7.08600 -6.63400 -0.44700 1.000 H66 H -5.38800 -6.33900 -0.89000 1.000 H67 H -5.89200 -6.24500 0.81400 1.000 H68 H 8.97200 0.94700 0.37100 1.000 H69 H 8.30000 -3.19700 -0.38000 1.000 H70 H 9.81000 -1.36700 0.27800 1.000