# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FDA' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy P0 P -1.66800 -0.57600 -3.23700 1.000 O1 O -0.81200 -1.77600 -3.37800 1.000 O2 O -3.19000 -1.02900 -2.97300 1.000 O3 O -1.59500 0.29600 -4.58800 1.000 C4 C -2.06600 -0.54000 -5.64700 1.000 C5 C -2.02200 0.23200 -6.96600 1.000 O6 O -0.66700 0.60600 -7.26900 1.000 C7 C -2.52100 -0.66400 -8.11600 1.000 O8 O -3.67000 -0.09200 -8.74300 1.000 C9 C -1.32700 -0.70700 -9.10500 1.000 O10 O -1.78200 -0.61800 -10.45600 1.000 C11 C -0.52800 0.55900 -8.70500 1.000 N12 N 0.88000 0.42500 -9.08300 1.000 C13 C 1.85900 -0.17100 -8.34600 1.000 N14 N 2.99300 -0.11100 -8.98200 1.000 C15 C 2.81400 0.52500 -10.16500 1.000 C16 C 3.65300 0.87200 -11.23700 1.000 N17 N 4.99900 0.55100 -11.21600 1.000 N18 N 3.12300 1.51500 -12.27300 1.000 C19 C 1.84000 1.82500 -12.30200 1.000 N20 N 1.01700 1.52100 -11.32000 1.000 C21 C 1.45500 0.87200 -10.24600 1.000 N22 N 2.54300 -1.35800 7.43200 1.000 C23 C 3.86400 -1.40500 7.69100 1.000 O24 O 4.56300 -2.19600 7.08800 1.000 N25 N 4.42200 -0.59100 8.60500 1.000 C26 C 3.66900 0.29400 9.28800 1.000 O27 O 4.18100 1.03000 10.11500 1.000 C28 C 2.29000 0.36200 9.03700 1.000 N29 N 1.47200 1.28100 9.74000 1.000 C30 C 0.07900 1.12700 9.67500 1.000 C31 C -0.75000 1.81300 10.54400 1.000 C32 C -2.12300 1.64400 10.46200 1.000 C33 C -3.02900 2.38800 11.40800 1.000 C34 C -2.66300 0.79000 9.52000 1.000 C35 C -4.15700 0.61100 9.43900 1.000 C36 C -1.83700 0.10500 8.64400 1.000 C37 C -0.46600 0.26900 8.71800 1.000 N38 N 0.38600 -0.41900 7.84100 1.000 C39 C 1.73700 -0.47100 8.10400 1.000 C40 C -0.15800 -1.08000 6.65300 1.000 C41 C -0.03800 -0.14400 5.44800 1.000 O42 O -0.85200 1.01100 5.66000 1.000 C43 C -0.50600 -0.87300 4.18700 1.000 O44 O 0.30700 -2.02800 3.97500 1.000 C45 C -0.38600 0.06200 2.98300 1.000 O46 O -1.20000 1.21800 3.19500 1.000 C47 C -0.85400 -0.66600 1.72200 1.000 O48 O -0.74200 0.20800 0.59700 1.000 P49 P -1.24800 -0.61900 -0.68700 1.000 O50 O -0.40000 -1.81800 -0.86700 1.000 O51 O -2.77700 -1.07200 -0.46500 1.000 O52 O -1.14900 0.31000 -1.99700 1.000 H53 H -3.71200 -0.22000 -2.88700 1.000 H54 H -1.43100 -1.42300 -5.72100 1.000 H55 H -3.09100 -0.84700 -5.43900 1.000 H56 H -2.64500 1.12300 -6.89400 1.000 H57 H -2.74700 -1.66500 -7.74700 1.000 H58 H -3.89600 -0.66500 -9.48800 1.000 H59 H -0.72900 -1.60700 -8.95600 1.000 H60 H -2.26800 -1.43300 -10.64200 1.000 H61 H -0.96400 1.44700 -9.16200 1.000 H62 H 1.71600 -0.62500 -7.37700 1.000 H63 H 5.56700 0.79600 -11.96300 1.000 H64 H 5.37300 0.08100 -10.45500 1.000 H65 H 1.45100 2.34900 -13.16200 1.000 H66 H 2.16000 -1.95300 6.76900 1.000 H67 H 5.37600 -0.64300 8.77500 1.000 H68 H 1.86700 2.00200 10.25400 1.000 H69 H -0.32900 2.47800 11.28400 1.000 H70 H -3.30400 3.34700 10.96900 1.000 H71 H -3.92900 1.80000 11.58800 1.000 H72 H -2.51000 2.55700 12.35200 1.000 H73 H -4.46000 -0.21300 10.08400 1.000 H74 H -4.65100 1.52700 9.76400 1.000 H75 H -4.44100 0.39100 8.41000 1.000 H76 H -2.26400 -0.55800 7.90500 1.000 H77 H 0.39900 -1.99600 6.45800 1.000 H78 H -1.20700 -1.32300 6.82100 1.000 H79 H 1.00000 0.16000 5.32700 1.000 H80 H -1.75800 0.69600 5.78000 1.000 H81 H -1.54600 -1.17800 4.30800 1.000 H82 H 1.21600 -1.71500 3.87300 1.000 H83 H 0.65200 0.36700 2.86200 1.000 H84 H -2.10900 0.90400 3.29700 1.000 H85 H -0.23300 -1.54700 1.56000 1.000 H86 H -1.89400 -0.97100 1.84300 1.000 H87 H -3.29500 -0.26300 -0.35200 1.000