# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '06T' 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 -2.60200 3.00400 1.68800 1.000 C1 C -2.37000 1.65600 1.05700 1.000 C2 C -1.19700 0.98800 0.97900 1.000 N3 N -1.40400 -0.21200 0.34300 1.000 C4 C -2.69600 -0.33900 0.00300 1.000 C5 C -3.35900 0.81400 0.40600 1.000 C6 C -4.78800 1.01200 0.15800 1.000 O7 O -5.37600 1.99700 0.55800 1.000 C8 C -5.50600 -0.06800 -0.62500 1.000 C9 C -4.89800 -1.43600 -0.33000 1.000 C10 C -3.40900 -1.47500 -0.68400 1.000 C11 C -5.08100 -1.76900 1.15100 1.000 C12 C -5.63200 -2.49100 -1.16600 1.000 C13 C -0.42600 -1.17700 0.09100 1.000 C14 C -0.57300 -2.08300 -0.95900 1.000 C15 C 0.39800 -3.00500 -1.22500 1.000 C16 C 1.58900 -3.02200 -0.48500 1.000 C17 C 1.76800 -2.08200 0.53300 1.000 C18 C 0.71000 -1.25300 0.87800 1.000 N19 N 2.99000 -1.91300 1.19500 1.000 C20 C 3.20300 -0.58400 1.81900 1.000 C21 C 3.22200 0.47100 0.70800 1.000 C22 C 2.85900 1.84500 1.27000 1.000 N23 N 1.97700 2.56200 0.32000 1.000 C24 C 0.56300 2.74700 0.73600 1.000 C25 C 0.11300 1.50600 1.50700 1.000 C26 C 2.42300 3.04200 -0.86200 1.000 O27 O 3.60600 3.00000 -1.12700 1.000 C28 C 1.45000 3.62800 -1.85200 1.000 C29 C 0.62000 2.50600 -2.47800 1.000 N30 N 2.19000 4.33500 -2.90600 1.000 C31 C 4.63100 0.52100 0.10600 1.000 C32 C 4.54800 -0.58000 2.54800 1.000 C33 C 2.62400 -4.02300 -0.79300 1.000 O34 O 3.66000 -4.04400 -0.15500 1.000 N35 N 2.42400 -4.91700 -1.78200 1.000 H36 H -2.45900 3.78400 0.94000 1.000 H37 H -3.62000 3.05300 2.07400 1.000 H38 H -1.89600 3.14900 2.50500 1.000 H39 H -6.56100 -0.07300 -0.34600 1.000 H40 H -5.42100 0.14400 -1.69200 1.000 H41 H -3.29100 -1.38200 -1.76500 1.000 H42 H -2.98500 -2.42500 -0.35300 1.000 H43 H -6.14400 -1.78600 1.39200 1.000 H44 H -4.64600 -2.74700 1.36000 1.000 H45 H -4.58300 -1.01300 1.75800 1.000 H46 H -5.52100 -2.25700 -2.22400 1.000 H47 H -5.20600 -3.47400 -0.96400 1.000 H48 H -6.69000 -2.49200 -0.90300 1.000 H49 H -1.45500 -2.05600 -1.58000 1.000 H50 H 0.24700 -3.73400 -2.00800 1.000 H51 H 0.74300 -0.74900 1.83500 1.000 H52 H 3.66200 -2.60900 1.25700 1.000 H53 H 2.40400 -0.37000 2.52300 1.000 H54 H 2.51200 0.19200 -0.06800 1.000 H55 H 2.36100 1.73600 2.23300 1.000 H56 H 3.77600 2.42900 1.41300 1.000 H57 H 0.48900 3.62400 1.37600 1.000 H58 H -0.06100 2.87900 -0.14600 1.000 H59 H 0.00300 1.75700 2.56500 1.000 H60 H 0.89400 0.75900 1.40100 1.000 H61 H 0.78800 4.32800 -1.34100 1.000 H62 H 0.09200 1.96300 -1.69300 1.000 H63 H -0.10300 2.93200 -3.17400 1.000 H64 H 1.27800 1.82100 -3.01300 1.000 H65 H 1.55900 4.73800 -3.58300 1.000 H66 H 2.79500 5.04000 -2.51200 1.000 H67 H 5.34700 0.79700 0.88000 1.000 H68 H 4.88900 -0.46000 -0.29500 1.000 H69 H 4.65800 1.26000 -0.69500 1.000 H70 H 5.34800 -0.78200 1.83600 1.000 H71 H 4.70900 0.39500 3.00800 1.000 H72 H 4.54600 -1.34900 3.32000 1.000 H73 H 1.59800 -4.90100 -2.29000 1.000 H74 H 3.10500 -5.57700 -1.98500 1.000