# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0HT' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 5.36700 -0.20600 1.61800 1.000 C1 C 5.69300 -0.52200 0.26400 1.000 C2 C 4.51900 -0.15000 -0.64400 1.000 C3 C 6.93400 0.26700 -0.15900 1.000 N4 N 6.66200 1.70600 -0.04300 1.000 C5 C 8.10800 -0.10400 0.74900 1.000 C6 C 9.37900 0.58300 0.24600 1.000 C7 C 10.51000 0.36400 1.25300 1.000 C8 C 9.77800 -0.00900 -1.10700 1.000 N9 N 3.32800 -0.90800 -0.23900 1.000 C10 C 2.14800 -0.48400 -1.00500 1.000 C11 C 0.97200 -0.33600 -0.07500 1.000 O12 O 1.06000 -0.70400 1.07800 1.000 C13 C 1.82700 -1.53400 -2.07000 1.000 C14 C 3.02900 -1.69800 -3.00300 1.000 C15 C 1.52200 -2.87100 -1.39200 1.000 N16 N -0.17800 0.20600 -0.52300 1.000 C17 C -1.28300 0.45200 0.40600 1.000 C18 C -2.58000 0.50800 -0.35900 1.000 O19 O -2.56700 0.56600 -1.57100 1.000 C20 C -1.05800 1.78300 1.12600 1.000 C21 C -2.13900 1.97600 2.19100 1.000 C22 C -1.13000 2.92800 0.11300 1.000 C23 C -1.96300 0.92800 3.29200 1.000 N24 N -3.75400 0.49300 0.30200 1.000 C25 C -5.01300 0.61300 -0.43700 1.000 C26 C -5.32600 2.06900 -0.66500 1.000 C27 C -6.14200 -0.03100 0.37000 1.000 C28 C -5.89200 -1.51200 0.49400 1.000 C29 C -5.16100 -2.00300 1.56000 1.000 C30 C -6.39700 -2.37900 -0.45600 1.000 C31 C -4.93100 -3.36100 1.67300 1.000 C32 C -6.16700 -3.73800 -0.34400 1.000 C33 C -5.43200 -4.22800 0.72000 1.000 O34 O -4.57300 2.92000 -0.25300 1.000 C35 C -6.67500 3.84200 -1.51000 1.000 O36 O -6.43900 2.42100 -1.32700 1.000 H37 H 4.31700 0.91800 -0.55900 1.000 H38 H 4.76800 -0.39100 -1.67800 1.000 H39 H 7.18400 0.02700 -1.19200 1.000 H40 H 6.53000 1.97300 0.92100 1.000 H41 H 7.39800 2.24900 -0.47200 1.000 H42 H 7.89800 0.22200 1.76700 1.000 H43 H 8.25000 -1.18500 0.73500 1.000 H44 H 9.19500 1.65200 0.13400 1.000 H45 H 10.75300 -0.69800 1.30000 1.000 H46 H 11.39100 0.92400 0.93800 1.000 H47 H 10.19300 0.70800 2.23700 1.000 H48 H 8.97300 0.14700 -1.82400 1.000 H49 H 10.68400 0.48100 -1.46500 1.000 H50 H 9.96300 -1.07800 -0.99500 1.000 H51 H 3.48200 -1.90100 -0.33200 1.000 H52 H 2.35300 0.47200 -1.48700 1.000 H53 H 0.96000 -1.21300 -2.64700 1.000 H54 H 3.86400 -2.12700 -2.44800 1.000 H55 H 2.76200 -2.36000 -3.82600 1.000 H56 H 3.31800 -0.72500 -3.39800 1.000 H57 H 2.36200 -3.15800 -0.76000 1.000 H58 H 0.62500 -2.77200 -0.78100 1.000 H59 H 1.36100 -3.63600 -2.15200 1.000 H60 H -0.27300 0.43300 -1.46100 1.000 H61 H -1.32800 -0.35400 1.13900 1.000 H62 H -0.07700 1.77800 1.60000 1.000 H63 H -2.05000 2.97400 2.62200 1.000 H64 H -3.12200 1.86300 1.73600 1.000 H65 H -2.13900 2.99000 -0.29500 1.000 H66 H -0.88100 3.86700 0.60800 1.000 H67 H -0.42100 2.74400 -0.69400 1.000 H68 H -2.77000 1.02500 4.01800 1.000 H69 H -1.98800 -0.06900 2.85100 1.000 H70 H -1.00500 1.08100 3.79000 1.000 H71 H -3.76600 0.40300 1.26800 1.000 H72 H -4.92000 0.10600 -1.39800 1.000 H73 H -6.17800 0.41600 1.36400 1.000 H74 H -7.09300 0.13600 -0.13700 1.000 H75 H -4.77000 -1.32500 2.30400 1.000 H76 H -6.97100 -1.99600 -1.28700 1.000 H77 H -4.36000 -3.74400 2.50500 1.000 H78 H -6.56100 -4.41600 -1.08600 1.000 H79 H -5.25200 -5.29000 0.80800 1.000 H80 H -6.74800 4.32700 -0.53600 1.000 H81 H -5.85000 4.27800 -2.07200 1.000 H82 H -7.60600 3.98800 -2.05800 1.000 H83 H 5.17500 0.73000 1.76900 1.000 H84 H 5.89500 -1.58900 0.17800 1.000