# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'FYI' 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 -4.04600 -1.49900 0.30800 1.000 C1 C -5.30300 -1.51400 -0.26400 1.000 C2 C -5.89000 -0.32700 -0.67800 1.000 C3 C -5.21300 0.87200 -0.51600 1.000 C4 C -3.95600 0.88200 0.05600 1.000 C5 C -3.37300 -0.30200 0.46800 1.000 O6 O -7.12700 -0.34000 -1.24200 1.000 P7 P -8.33000 -0.18300 -0.18400 1.000 O8 O -9.74000 -0.34300 -0.94600 1.000 O9 O -8.21100 -1.22700 0.85800 1.000 O10 O -8.25400 1.27100 0.50300 1.000 C11 C -2.00200 -0.28800 1.09300 1.000 C12 C -0.94200 -0.44400 0.00100 1.000 C13 C 0.42100 -0.55300 0.63500 1.000 O14 O 0.54500 -0.41400 1.83300 1.000 C15 C -0.97800 0.77500 -0.92300 1.000 C16 C -0.57600 2.00400 -0.14900 1.000 N17 N -0.44700 3.18700 -0.78200 1.000 C18 C -0.05600 4.38200 -0.02900 1.000 O19 O -0.36700 1.92900 1.04300 1.000 N20 N 1.50200 -0.80600 -0.13000 1.000 C21 C 2.80800 -1.02100 0.49700 1.000 C22 C 3.89800 -0.59200 -0.45200 1.000 O23 O 3.66000 -0.47900 -1.63600 1.000 C24 C 2.97600 -2.50500 0.83000 1.000 C25 C 4.28200 -2.71100 1.60100 1.000 C26 C 3.01700 -3.31700 -0.46700 1.000 C27 C 4.18500 -2.01700 2.96100 1.000 N28 N 5.13500 -0.33500 0.01500 1.000 C29 C 6.15000 0.23600 -0.87400 1.000 C30 C 6.82600 -0.87100 -1.64100 1.000 O31 O 6.49400 -2.02400 -1.46200 1.000 C32 C 7.19000 0.99100 -0.04400 1.000 C33 C 6.53700 2.17200 0.62600 1.000 O34 O 5.35600 2.38900 0.45600 1.000 N35 N 7.26500 2.98700 1.41400 1.000 N36 N 7.80000 -0.58100 -2.52600 1.000 H37 H -3.59100 -2.42200 0.63500 1.000 H38 H -5.82900 -2.45000 -0.38900 1.000 H39 H -5.66800 1.79800 -0.83800 1.000 H40 H -3.42800 1.81600 0.18200 1.000 H41 H -10.51100 -0.25900 -0.36900 1.000 H42 H -8.32600 2.00600 -0.12100 1.000 H43 H -1.85000 0.65700 1.61500 1.000 H44 H -1.91700 -1.11200 1.80200 1.000 H45 H -1.14600 -1.34400 -0.57800 1.000 H46 H -0.28500 0.62500 -1.75100 1.000 H47 H -1.98700 0.90600 -1.31300 1.000 H48 H -0.61400 3.24800 -1.73500 1.000 H49 H -0.79300 4.57800 0.74900 1.000 H50 H 0.92000 4.22000 0.42700 1.000 H51 H -0.00400 5.23600 -0.70500 1.000 H52 H 1.41500 -0.84500 -1.09500 1.000 H53 H 2.87300 -0.43400 1.41300 1.000 H54 H 2.13700 -2.83800 1.44100 1.000 H55 H 4.45200 -3.77700 1.74800 1.000 H56 H 5.10900 -2.28500 1.03300 1.000 H57 H 3.91000 -3.05300 -1.03300 1.000 H58 H 3.03700 -4.38000 -0.22900 1.000 H59 H 2.13100 -3.09400 -1.06200 1.000 H60 H 5.14000 -2.09900 3.47900 1.000 H61 H 3.94100 -0.96400 2.81500 1.000 H62 H 3.40600 -2.49200 3.55700 1.000 H63 H 5.35400 -0.52700 0.94000 1.000 H64 H 5.67400 0.92400 -1.57400 1.000 H65 H 7.60200 0.32500 0.71400 1.000 H66 H 7.99100 1.33900 -0.69600 1.000 H67 H 8.21000 2.81400 1.55000 1.000 H68 H 6.84500 3.74800 1.84500 1.000 H69 H 8.06600 0.34100 -2.66900 1.000 H70 H 8.23600 -1.29400 -3.01900 1.000