# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C6A' 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 -5.15900 -0.00600 -0.99100 1.000 C1 C -4.73200 -1.06500 -0.21200 1.000 C2 C -5.49700 -1.49100 0.85700 1.000 C3 C -6.69300 -0.85700 1.14900 1.000 C4 C -7.12100 0.20400 0.37000 1.000 C5 C -6.35100 0.63300 -0.69700 1.000 F6 F -6.76800 1.66800 -1.45800 1.000 F7 F -7.44100 -1.27300 2.19400 1.000 C8 C -3.43100 -1.75700 -0.52900 1.000 C9 C -2.29100 -1.07200 0.22900 1.000 C10 C -0.99200 -1.84800 0.00700 1.000 C11 C 0.14700 -1.16400 0.76500 1.000 N12 N 1.41600 -1.83800 0.45600 1.000 C13 C 2.53500 -1.20600 1.16700 1.000 C14 C 3.03700 -0.03000 0.36900 1.000 C15 C 4.19300 -0.11300 -0.38700 1.000 O16 O 4.93200 -1.25100 -0.44300 1.000 C17 C 4.31800 -2.46800 -0.01600 1.000 C18 C 3.66300 -2.22500 1.34900 1.000 C19 C 2.31800 1.15300 0.40100 1.000 C20 C 2.74700 2.25000 -0.32000 1.000 C21 C 3.90100 2.16900 -1.07900 1.000 C22 C 4.62200 0.99300 -1.11400 1.000 C23 C 1.95900 3.53400 -0.28000 1.000 C24 C 2.46900 4.40900 0.86600 1.000 C25 C 3.94900 4.72600 0.64700 1.000 C26 C 1.66900 5.71300 0.90600 1.000 C27 C 2.29700 3.66500 2.19200 1.000 C28 C 5.37700 -3.56400 0.10800 1.000 C29 C 6.84400 -3.14900 -0.02700 1.000 C30 C 6.16400 -3.93300 -1.15100 1.000 O31 O -1.14800 -3.18500 0.48600 1.000 N32 N -2.13200 0.29900 -0.26300 1.000 C33 C -1.83900 0.51900 -1.55900 1.000 C34 C -1.67400 1.92900 -2.06600 1.000 O35 O -1.70700 -0.41700 -2.31900 1.000 H36 H -4.56000 0.32500 -1.82600 1.000 H37 H -5.16200 -2.31900 1.46500 1.000 H38 H -8.05400 0.70000 0.59700 1.000 H39 H -3.49200 -2.80200 -0.22700 1.000 H40 H -3.24000 -1.69900 -1.60000 1.000 H41 H -2.52400 -1.05100 1.29400 1.000 H42 H -0.75900 -1.86900 -1.05800 1.000 H43 H 0.20800 -0.11900 0.46200 1.000 H44 H -0.04300 -1.22200 1.83600 1.000 H45 H 1.36200 -2.82300 0.66700 1.000 H46 H 2.19500 -0.86300 2.14500 1.000 H47 H 3.56000 -2.77000 -0.73900 1.000 H48 H 4.40300 -1.83300 2.04700 1.000 H49 H 3.25400 -3.16000 1.73200 1.000 H50 H 1.41600 1.21800 0.99200 1.000 H51 H 4.23700 3.02600 -1.64400 1.000 H52 H 5.52200 0.93200 -1.70700 1.000 H53 H 2.08200 4.06400 -1.22500 1.000 H54 H 0.90500 3.30800 -0.12400 1.000 H55 H 4.07200 5.25700 -0.29700 1.000 H56 H 4.31200 5.35000 1.46400 1.000 H57 H 4.51900 3.79800 0.61800 1.000 H58 H 0.61400 5.48700 1.06200 1.000 H59 H 2.03100 6.33700 1.72300 1.000 H60 H 1.79100 6.24400 -0.03800 1.000 H61 H 2.86700 2.73600 2.16300 1.000 H62 H 2.66000 4.28800 3.00900 1.000 H63 H 1.24200 3.43900 2.34800 1.000 H64 H 5.14400 -4.36600 0.80900 1.000 H65 H 7.05300 -2.09400 -0.20500 1.000 H66 H 7.57500 -3.67700 0.58400 1.000 H67 H 6.44800 -4.97700 -1.27900 1.000 H68 H 5.92600 -3.39400 -2.06800 1.000 H69 H -1.35700 -3.24300 1.42900 1.000 H70 H -2.23700 1.04700 0.34500 1.000 H71 H -1.82800 2.63000 -1.24500 1.000 H72 H -0.66900 2.05600 -2.46800 1.000 H73 H -2.40700 2.12200 -2.84900 1.000