# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FLD' 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 8.49000 -1.07200 -0.68000 1.000 N1 N 7.92100 -2.22500 -0.95300 1.000 C2 C 8.49500 -3.38800 -0.68000 1.000 C3 C 9.72300 -3.46400 -0.09400 1.000 C4 C 11.66100 -2.26100 0.83100 1.000 C5 C 12.28200 -1.09200 1.12900 1.000 N6 N 12.12800 1.44500 1.05700 1.000 C7 C 11.14400 3.73900 0.58900 1.000 C8 C 10.05000 4.39400 0.06800 1.000 C9 C 8.97500 3.67700 -0.44600 1.000 O10 O 7.90100 4.33700 -0.95800 1.000 C11 C 8.99100 2.29500 -0.43200 1.000 C12 C 10.39400 -2.27100 0.22700 1.000 C13 C 11.69300 0.15000 0.84900 1.000 C14 C 11.18200 2.34800 0.60600 1.000 C15 C 10.09700 1.62200 0.08800 1.000 C16 C 10.43400 0.20100 0.24800 1.000 C17 C 9.75200 -1.04200 -0.07800 1.000 C18 C 8.17500 5.73400 -0.82700 1.000 C19 C 6.59900 -2.22400 -1.58400 1.000 C20 C 5.51800 -2.22500 -0.50100 1.000 N21 N 4.19200 -2.22500 -1.13400 1.000 C22 C 3.15300 -2.22600 -0.09500 1.000 C23 C 1.77300 -2.22500 -0.75400 1.000 C24 C 0.69100 -2.22600 0.32800 1.000 C25 C -8.49100 -1.07400 0.68400 1.000 N26 N -7.92000 -2.22700 0.95000 1.000 C27 C -8.49400 -3.39000 0.67500 1.000 C28 C -9.72200 -3.46500 0.08900 1.000 C29 C -11.65900 -2.26100 -0.83500 1.000 C30 C -12.28000 -1.09200 -1.13000 1.000 N31 N -12.12800 1.44500 -1.05500 1.000 C32 C -11.14600 3.73800 -0.58500 1.000 C33 C -10.05300 4.39400 -0.06300 1.000 C34 C -8.97600 3.67700 0.44900 1.000 O35 O -7.90400 4.33800 0.96100 1.000 C36 C -8.99500 2.29600 0.44000 1.000 C37 C -10.39200 -2.27100 -0.23000 1.000 C38 C -11.69200 0.14900 -0.84800 1.000 C39 C -11.18300 2.34700 -0.60400 1.000 C40 C -10.09700 1.62200 -0.08600 1.000 C41 C -10.43300 0.20100 -0.24700 1.000 C42 C -9.75100 -1.04300 0.07700 1.000 C43 C -8.17800 5.73400 0.83200 1.000 C44 C -6.59800 -2.22700 1.58100 1.000 C45 C -5.51600 -2.22700 0.49900 1.000 N46 N -4.19100 -2.22700 1.13100 1.000 C47 C -3.15200 -2.22600 0.09200 1.000 C48 C -1.77100 -2.22700 0.75100 1.000 C49 C -0.69000 -2.22600 -0.33100 1.000 H50 H 7.98400 -0.14900 -0.92100 1.000 H51 H 7.97500 -4.30100 -0.92900 1.000 H52 H 10.17300 -4.42300 0.11900 1.000 H53 H 12.14800 -3.19700 1.06300 1.000 H54 H 13.25600 -1.11800 1.59300 1.000 H55 H 12.97600 1.68700 1.46200 1.000 H56 H 11.97400 4.30500 0.98500 1.000 H57 H 10.02800 5.47400 0.05700 1.000 H58 H 8.15300 1.73900 -0.82500 1.000 H59 H 9.08100 5.98000 -1.38100 1.000 H60 H 7.33800 6.30700 -1.22600 1.000 H61 H 8.31400 5.97900 0.22600 1.000 H62 H 6.49200 -1.33400 -2.20300 1.000 H63 H 6.49300 -3.11400 -2.20500 1.000 H64 H 5.62400 -3.11600 0.11800 1.000 H65 H 5.62400 -1.33600 0.11900 1.000 H66 H 4.09300 -1.40100 -1.70800 1.000 H67 H 4.09300 -3.04800 -1.70900 1.000 H68 H 3.26000 -3.11600 0.52400 1.000 H69 H 3.26000 -1.33600 0.52600 1.000 H70 H 1.66600 -1.33500 -1.37400 1.000 H71 H 1.66600 -3.11500 -1.37500 1.000 H72 H 0.79800 -3.11700 0.94800 1.000 H73 H 0.79800 -1.33700 0.94900 1.000 H74 H -7.98700 -0.15100 0.93000 1.000 H75 H -7.97300 -4.30300 0.92300 1.000 H76 H -10.17100 -4.42300 -0.12700 1.000 H77 H -12.14500 -3.19700 -1.06800 1.000 H78 H -13.25500 -1.11800 -1.59500 1.000 H79 H -12.97600 1.68600 -1.45900 1.000 H80 H -11.97600 4.30400 -0.98100 1.000 H81 H -10.03100 5.47400 -0.05300 1.000 H82 H -8.15900 1.74000 0.83900 1.000 H83 H -8.31800 5.98100 -0.22100 1.000 H84 H -9.08400 5.98000 1.38600 1.000 H85 H -7.34200 6.30800 1.23100 1.000 H86 H -6.49100 -3.11800 2.20000 1.000 H87 H -6.49100 -1.33800 2.20200 1.000 H88 H -5.62300 -1.33600 -0.12100 1.000 H89 H -5.62300 -3.11600 -0.12200 1.000 H90 H -4.09200 -3.05100 1.70500 1.000 H91 H -4.09200 -1.40400 1.70600 1.000 H92 H -3.25900 -1.33600 -0.52700 1.000 H93 H -3.25900 -3.11600 -0.52900 1.000 H94 H -1.66500 -3.11700 1.37100 1.000 H95 H -1.66500 -1.33700 1.37200 1.000 H96 H -0.79600 -1.33500 -0.95000 1.000 H97 H -0.79600 -3.11500 -0.95200 1.000