# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C41' 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 -10.92600 -4.23200 -0.38400 1.000 O1 O -10.67400 -2.82800 -0.47500 1.000 C2 C -9.33600 -2.45500 -0.14000 1.000 C3 C -9.18200 -0.93900 -0.27200 1.000 C4 C -7.74900 -0.53900 0.08700 1.000 O5 O -7.60500 0.87700 -0.03600 1.000 C6 C -6.38200 1.40000 0.25000 1.000 C7 C -5.34500 0.56800 0.63900 1.000 C8 C -4.10300 1.10200 0.92900 1.000 C9 C -3.89200 2.46500 0.83100 1.000 C10 C -4.92300 3.30000 0.44300 1.000 C11 C -6.16900 2.77200 0.14500 1.000 O12 O -7.18200 3.59100 -0.24200 1.000 C13 C -6.89100 4.98800 -0.32700 1.000 C14 C -2.97600 0.19600 1.35300 1.000 C15 C -1.83300 0.29500 0.34100 1.000 C16 C -2.20200 -0.48300 -0.92300 1.000 C17 C -2.60300 -1.91000 -0.54500 1.000 C18 C -3.37500 0.20700 -1.62300 1.000 C19 C -0.55900 -0.29600 0.95000 1.000 C20 C 0.62200 -0.03300 0.01400 1.000 N21 N 0.43200 -0.78000 -1.23600 1.000 C22 C 1.91800 -0.48900 0.68900 1.000 O23 O 1.83900 -1.88700 0.97600 1.000 C24 C 3.10000 -0.22600 -0.24700 1.000 C25 C 4.40900 -0.47800 0.50300 1.000 C26 C 4.52100 -1.96400 0.85000 1.000 C27 C 4.48700 -2.79200 -0.43600 1.000 C28 C 5.83900 -2.21800 1.58500 1.000 C29 C 5.57200 -0.07600 -0.36800 1.000 O30 O 5.40200 0.12500 -1.55100 1.000 N31 N 6.80100 0.05800 0.16900 1.000 C32 C 7.94300 0.38300 -0.68900 1.000 C33 C 9.21000 0.47800 0.16300 1.000 C34 C 9.03600 1.57400 1.21700 1.000 C35 C 9.45900 -0.86200 0.85800 1.000 C36 C 10.38500 0.81200 -0.71900 1.000 O37 O 10.22500 0.96000 -1.91200 1.000 N38 N 11.61400 0.94700 -0.18200 1.000 H39 H -10.26300 -4.76500 -1.06600 1.000 H40 H -10.74500 -4.56800 0.63700 1.000 H41 H -11.96300 -4.43300 -0.65400 1.000 H42 H -9.12200 -2.75400 0.88600 1.000 H43 H -8.64000 -2.95100 -0.81600 1.000 H44 H -9.39600 -0.63900 -1.29800 1.000 H45 H -9.87800 -0.44200 0.40500 1.000 H46 H -7.53500 -0.83800 1.11300 1.000 H47 H -7.05300 -1.03500 -0.58900 1.000 H48 H -5.50700 -0.49600 0.71700 1.000 H49 H -2.92100 2.87800 1.05900 1.000 H50 H -2.61700 0.49800 2.33700 1.000 H51 H -3.33400 -0.83300 1.39700 1.000 H52 H -4.75600 4.36500 0.36700 1.000 H53 H -6.57600 5.35300 0.65000 1.000 H54 H -6.09100 5.14900 -1.05000 1.000 H55 H -7.78300 5.52700 -0.64600 1.000 H56 H -1.66300 1.34100 0.08700 1.000 H57 H -1.34500 -0.51300 -1.59500 1.000 H58 H -0.36800 0.17100 1.91600 1.000 H59 H -0.68500 -1.37000 1.08300 1.000 H60 H -3.47200 -1.88100 0.11300 1.000 H61 H -2.85000 -2.47000 -1.44700 1.000 H62 H -1.77400 -2.39700 -0.03100 1.000 H63 H -3.07900 1.21400 -1.91800 1.000 H64 H -3.65600 -0.36300 -2.50900 1.000 H65 H -4.22300 0.26300 -0.94100 1.000 H66 H 0.68200 1.03300 -0.20500 1.000 H67 H 1.20300 -0.62700 -1.87000 1.000 H68 H 0.30500 -1.76500 -1.05400 1.000 H69 H 2.05900 0.06500 1.61700 1.000 H70 H 1.78500 -2.44700 0.19000 1.000 H71 H 3.03900 -0.89500 -1.10600 1.000 H72 H 3.07000 0.80800 -0.58900 1.000 H73 H 4.42200 0.11100 1.42000 1.000 H74 H 3.68700 -2.25200 1.49000 1.000 H75 H 5.26100 -2.43800 -1.11700 1.000 H76 H 4.66300 -3.84100 -0.19800 1.000 H77 H 3.51100 -2.68600 -0.91000 1.000 H78 H 5.93500 -1.51500 2.41200 1.000 H79 H 5.84800 -3.23700 1.97200 1.000 H80 H 6.67200 -2.08500 0.89500 1.000 H81 H 6.92900 -0.06000 1.12300 1.000 H82 H 8.06800 -0.39800 -1.43900 1.000 H83 H 7.76600 1.33800 -1.18400 1.000 H84 H 8.18600 1.33200 1.85500 1.000 H85 H 9.93800 1.64100 1.82400 1.000 H86 H 8.85800 2.52900 0.72200 1.000 H87 H 9.58300 -1.64300 0.10800 1.000 H88 H 10.36200 -0.79500 1.46500 1.000 H89 H 8.60900 -1.10400 1.49700 1.000 H90 H 11.74300 0.82800 0.77200 1.000 H91 H 12.37100 1.16200 -0.75000 1.000