# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'J6T' 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 -1.65600 -0.58200 -2.04700 1.000 C1 C -1.53600 0.31000 -0.98300 1.000 C2 C -0.29800 0.88300 -0.69800 1.000 C3 C 4.60300 1.95500 -0.35700 1.000 C4 C 5.85800 2.37800 0.03600 1.000 C5 C 6.59800 1.62000 0.92400 1.000 C6 C 6.08400 0.43700 1.42200 1.000 C7 C 4.82900 0.01000 1.03300 1.000 C8 C 4.26900 -1.28000 1.57600 1.000 C9 C 4.55600 -2.39900 0.60800 1.000 C10 C -3.95900 0.07600 -0.44200 1.000 C11 C -5.05700 0.39000 0.33300 1.000 C12 C -4.93000 1.27100 1.39100 1.000 C13 C -3.70400 1.84200 1.67900 1.000 C14 C -2.59900 1.53500 0.91100 1.000 C15 C -6.39600 -0.22900 0.02500 1.000 C16 C -6.64900 -1.39800 0.97900 1.000 C17 C 0.80100 0.56500 -1.46900 1.000 C18 C 0.67500 -0.32100 -2.52500 1.000 C19 C -0.55100 -0.89300 -2.81200 1.000 C20 C -2.72100 0.64900 -0.15700 1.000 C21 C 2.14000 1.18400 -1.16200 1.000 O22 O 2.84800 0.35400 -0.23800 1.000 C23 C 4.08300 0.77200 0.14600 1.000 O24 O 5.15300 -2.17200 -0.41700 1.000 O25 O 4.14700 -3.64700 0.88500 1.000 N26 N -7.45100 0.77900 0.19500 1.000 O27 O -7.86400 -2.05700 0.61400 1.000 H28 H -2.61200 -1.03200 -2.26900 1.000 H29 H -0.19900 1.57500 0.12500 1.000 H30 H 4.02500 2.54800 -1.05000 1.000 H31 H 6.26200 3.30200 -0.35200 1.000 H32 H 7.58000 1.95200 1.22900 1.000 H33 H 6.66400 -0.15400 2.11600 1.000 H34 H 4.73500 -1.50200 2.53600 1.000 H35 H 3.19200 -1.18100 1.70900 1.000 H36 H -4.05800 -0.61500 -1.26600 1.000 H37 H -5.79200 1.51400 1.99500 1.000 H38 H -3.61000 2.53000 2.50700 1.000 H39 H -1.64200 1.98200 1.13600 1.000 H40 H -6.40200 -0.59100 -1.00300 1.000 H41 H -5.82100 -2.10300 0.91800 1.000 H42 H -6.73200 -1.02300 2.00000 1.000 H43 H 1.53800 -0.56700 -3.12600 1.000 H44 H -0.64300 -1.58400 -3.63700 1.000 H45 H 2.71700 1.27600 -2.08200 1.000 H46 H 1.99300 2.17100 -0.72500 1.000 H47 H 4.35400 -4.33100 0.23400 1.000 H48 H -7.46700 1.13100 1.14000 1.000 H49 H -7.34300 1.53100 -0.46900 1.000 H50 H -8.08700 -2.81000 1.17800 1.000