# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9G6' 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 -5.08800 -2.11100 -0.98800 1.000 C1 C -4.74000 -3.59800 -1.09500 1.000 C2 C -4.29400 -3.68200 1.25700 1.000 C3 C 1.76800 -0.68300 -1.00700 1.000 N4 N 4.73400 0.03600 1.04700 1.000 C5 C 6.05800 -0.13800 0.86600 1.000 C6 C 6.36800 -0.71500 -0.36900 1.000 C7 C 8.41700 -0.07000 1.38100 1.000 C8 C 7.69200 -0.96500 -0.71800 1.000 C9 C -0.94500 4.99900 -0.28300 1.000 C10 C -1.55300 2.70100 -0.25400 1.000 C11 C -1.24500 1.33800 -0.36200 1.000 C12 C -2.21600 0.38900 -0.21100 1.000 C13 C -3.53400 0.78200 0.05400 1.000 C14 C -3.85200 2.15800 0.16400 1.000 C15 C -2.84100 3.11300 0.00600 1.000 C16 C -4.57700 -0.16000 0.21800 1.000 N17 N -5.79900 0.29300 0.46600 1.000 C18 C -6.04900 1.59000 0.56000 1.000 N19 N -5.12300 2.50700 0.41700 1.000 N20 N -4.33100 -1.51400 0.12200 1.000 O21 O -5.01500 -4.23800 0.15400 1.000 C22 C -4.63700 -2.19600 1.38800 1.000 O23 O 0.03400 0.95500 -0.61900 1.000 C24 C 0.28500 -0.44800 -0.71700 1.000 N25 N 2.56700 -0.22500 0.13200 1.000 C26 C 3.94300 -0.33600 0.09900 1.000 S27 S 4.86400 -1.00300 -1.24100 1.000 C28 C 7.11700 0.18300 1.74100 1.000 C29 C 8.71000 -0.64400 0.15300 1.000 O30 O -0.56900 3.62600 -0.40300 1.000 H31 H -4.82600 -1.60800 -1.91800 1.000 H32 H -6.15600 -2.00000 -0.80200 1.000 H33 H -5.34100 -4.05700 -1.87900 1.000 H34 H -3.68200 -3.70800 -1.33500 1.000 H35 H -4.57300 -4.20300 2.17300 1.000 H36 H -3.22300 -3.79500 1.08600 1.000 H37 H 1.94300 -1.74600 -1.17000 1.000 H38 H 2.05600 -0.12600 -1.90000 1.000 H39 H 9.21900 0.18000 2.06000 1.000 H40 H 7.92200 -1.41200 -1.67400 1.000 H41 H -1.69000 5.23900 -1.04100 1.000 H42 H -1.36500 5.17500 0.70800 1.000 H43 H -0.06700 5.63000 -0.42300 1.000 H44 H -1.96900 -0.65900 -0.29600 1.000 H45 H -3.06900 4.16600 0.08700 1.000 H46 H -7.06200 1.90600 0.76300 1.000 H47 H -5.69800 -2.08600 1.61300 1.000 H48 H -4.04700 -1.75600 2.19100 1.000 H49 H -0.31500 -0.86900 -1.52400 1.000 H50 H 0.01800 -0.93100 0.22300 1.000 H51 H 2.13000 0.15600 0.91000 1.000 H52 H 6.90400 0.63000 2.70100 1.000 H53 H 9.73700 -0.83800 -0.12100 1.000