# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C1G' 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 -1.22700 0.91800 0.86600 1.000 C1 C -3.11900 -0.50400 1.44700 1.000 C2 C -2.52300 -1.90600 1.58000 1.000 C3 C -4.54700 -0.60700 0.97800 1.000 C4 C -5.62400 -0.50400 1.84200 1.000 C5 C -6.82100 -0.61800 1.26400 1.000 C6 C -0.49300 1.80700 -0.10400 1.000 C7 C -1.38100 2.88800 -0.74200 1.000 C8 C 0.32600 1.03200 -1.10400 1.000 C9 C 1.78100 -0.83600 -1.68000 1.000 C10 C 2.98800 -1.50200 -1.01600 1.000 C11 C 5.19900 -1.09600 0.07400 1.000 N12 N 6.16100 -0.06900 0.48200 1.000 C13 C 7.30800 -0.42500 1.09200 1.000 O14 O 7.54500 -1.59900 1.30400 1.000 O15 O -0.81900 0.79200 2.00100 1.000 N16 N -2.34100 0.26800 0.47400 1.000 S17 S -6.62000 -0.87100 -0.46500 1.000 C18 C -4.87000 -0.80000 -0.30200 1.000 C19 C -0.19000 3.84800 -0.58700 1.000 C20 C 0.27900 2.95200 0.57200 1.000 O21 O 0.31200 1.34700 -2.27400 1.000 N22 N 1.07500 -0.01200 -0.69600 1.000 C23 C 3.99200 -0.43000 -0.59000 1.000 N24 N 8.19300 0.52000 1.46700 1.000 C25 C 0.83600 -1.91200 -2.21700 1.000 N26 N -0.37800 -1.27700 -2.74800 1.000 H27 H -3.09000 -0.00300 2.41400 1.000 H28 H -3.10200 -2.48000 2.30400 1.000 H29 H -2.55200 -2.40700 0.61200 1.000 H30 H -1.49000 -1.83100 1.91900 1.000 H31 H -5.50400 -0.34300 2.90300 1.000 H32 H -7.76900 -0.56600 1.78000 1.000 H33 H -1.64300 2.68200 -1.78000 1.000 H34 H -2.24400 3.16000 -0.13400 1.000 H35 H 2.12100 -0.20700 -2.50300 1.000 H36 H 2.65800 -2.06000 -0.14000 1.000 H37 H 3.46100 -2.18300 -1.72300 1.000 H38 H 5.67200 -1.77700 -0.63300 1.000 H39 H 4.86900 -1.65400 0.95100 1.000 H40 H 5.97100 0.86700 0.31300 1.000 H41 H -2.62600 0.31000 -0.45200 1.000 H42 H -4.16500 -0.90300 -1.11300 1.000 H43 H 0.48700 3.84600 -1.44100 1.000 H44 H -0.47500 4.85200 -0.27600 1.000 H45 H -0.12900 3.24200 1.54100 1.000 H46 H 1.35800 2.79700 0.59600 1.000 H47 H 1.14600 -0.21800 0.24900 1.000 H48 H 4.32200 0.12800 -1.46700 1.000 H49 H 3.51900 0.25200 0.11700 1.000 H50 H 8.00400 1.45600 1.29800 1.000 H51 H 9.01900 0.26300 1.90600 1.000 H52 H 1.33200 -2.46800 -3.01300 1.000 H53 H 0.56600 -2.59400 -1.41100 1.000 H54 H -0.15000 -0.59200 -3.45300 1.000 H55 H -1.01900 -1.96800 -3.10900 1.000