# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'F5E' 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 0.00100 -1.25700 -1.49600 1.000 C1 C -0.85800 -0.18300 -2.16600 1.000 C2 C -0.05700 0.48700 -3.28400 1.000 C3 C -2.11400 -0.82900 -2.75500 1.000 C4 C -2.96400 -1.38200 -1.64000 1.000 C5 C -2.83700 -2.72500 -1.28900 1.000 C6 C -3.56700 -3.29200 -0.29800 1.000 C7 C -4.50300 -2.52300 0.42700 1.000 C8 C -5.62400 -0.59600 0.92900 1.000 C9 C -4.66100 -1.10200 0.08100 1.000 C10 C -3.83800 -0.55400 -0.99400 1.000 C11 C -2.00400 1.87200 0.26700 1.000 O12 O -4.46400 1.61100 0.91200 1.000 S13 S -3.69300 1.97100 -0.22600 1.000 O14 O -3.84100 3.21000 -0.90500 1.000 N15 N -3.94400 0.78600 -1.35500 1.000 N16 N -5.34200 -2.76800 1.41600 1.000 N17 N -6.03200 -1.59100 1.72900 1.000 C18 C -7.04900 -1.46500 2.77600 1.000 C19 C -1.05900 2.68100 -0.33600 1.000 C20 C 0.26600 2.60300 0.05000 1.000 C21 C 0.64600 1.71500 1.03900 1.000 C22 C -0.29800 0.90600 1.64200 1.000 C23 C -1.62400 0.98800 1.26000 1.000 C24 C 2.09200 1.62600 1.45500 1.000 C25 C 2.80700 0.58400 0.59300 1.000 C26 C 4.27500 0.49300 1.01600 1.000 C27 C 4.99000 -0.54900 0.15400 1.000 C28 C 6.45800 -0.64000 0.57700 1.000 C29 C 7.14400 -1.76800 -0.19800 1.000 C30 C 8.62600 -1.81500 0.18400 1.000 N31 N 9.25500 -0.52600 -0.13200 1.000 C32 C 10.70500 -0.58000 0.09200 1.000 C33 C 8.64300 0.56600 0.63600 1.000 C34 C 7.16200 0.68300 0.26700 1.000 H35 H 0.89600 -0.79700 -1.07600 1.000 H36 H -0.57000 -1.73500 -0.69900 1.000 H37 H 0.28900 -2.00500 -2.23500 1.000 H38 H -1.14700 0.56500 -1.42700 1.000 H39 H 0.23100 -0.26100 -4.02300 1.000 H40 H -0.67000 1.25200 -3.76100 1.000 H41 H 0.83700 0.94700 -2.86400 1.000 H42 H -2.68200 -0.08100 -3.30800 1.000 H43 H -1.82600 -1.63700 -3.42700 1.000 H44 H -2.12900 -3.33700 -1.82800 1.000 H45 H -3.43300 -4.33800 -0.06200 1.000 H46 H -5.98400 0.42200 0.94700 1.000 H47 H -4.16600 1.02600 -2.26800 1.000 H48 H -8.03200 -1.68100 2.35600 1.000 H49 H -6.83400 -2.17100 3.57800 1.000 H50 H -7.03800 -0.45000 3.17300 1.000 H51 H -1.35700 3.37500 -1.10900 1.000 H52 H 1.00300 3.23500 -0.42100 1.000 H53 H -0.00100 0.21300 2.41500 1.000 H54 H -2.36200 0.35600 1.73100 1.000 H55 H 2.56900 2.59700 1.32200 1.000 H56 H 2.15000 1.33200 2.50300 1.000 H57 H 2.33000 -0.38700 0.72600 1.000 H58 H 2.74800 0.87700 -0.45500 1.000 H59 H 4.75200 1.46400 0.88300 1.000 H60 H 4.33300 0.19900 2.06400 1.000 H61 H 4.51300 -1.52000 0.28700 1.000 H62 H 4.93100 -0.25600 -0.89400 1.000 H63 H 6.51800 -0.84400 1.64600 1.000 H64 H 6.67400 -2.72000 0.05100 1.000 H65 H 7.05000 -1.58500 -1.26800 1.000 H66 H 8.71900 -2.01300 1.25200 1.000 H67 H 9.12000 -2.60800 -0.37700 1.000 H68 H 11.14400 -1.34800 -0.54500 1.000 H69 H 11.14600 0.38700 -0.14900 1.000 H70 H 10.90300 -0.81800 1.13700 1.000 H71 H 8.73700 0.35700 1.70200 1.000 H72 H 9.15100 1.50200 0.40300 1.000 H73 H 7.06900 0.90600 -0.79600 1.000 H74 H 6.70500 1.48400 0.84900 1.000