# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '9LD' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N 0.33100 -3.21000 -0.33200 1.000 C1 C -0.86600 -0.97100 -0.39800 1.000 C2 C 2.43900 -2.57200 -0.27600 1.000 C3 C 2.17500 -0.02200 -0.33000 1.000 C4 C -6.32400 2.29000 0.49100 1.000 C5 C -0.79300 -4.04400 -0.35400 1.000 C6 C -5.07600 1.50600 0.55400 1.000 C7 C 4.14500 3.42900 -0.08300 1.000 C8 C 6.04500 4.10100 -1.17400 1.000 C9 C 4.79700 4.40500 -0.81600 1.000 C10 C -4.94400 0.47200 1.48600 1.000 C11 C -7.66000 5.09900 -1.49100 1.000 C12 C -7.70400 4.01500 -0.41300 1.000 O13 O -6.44900 3.28600 -0.40700 1.000 O14 O -7.23900 2.03700 1.25000 1.000 C15 C -3.77900 -0.25800 1.54200 1.000 C16 C -2.73200 0.03300 0.67200 1.000 N17 N -1.55400 -0.70800 0.73100 1.000 O18 O -1.22600 -0.49000 -1.45600 1.000 C19 C 0.32100 -1.83800 -0.35100 1.000 C20 C 1.63100 -1.43000 -0.31800 1.000 N21 N 3.61300 -0.11100 -0.01700 1.000 C22 C 4.41600 -1.14300 -0.68700 1.000 C23 C 3.94800 -2.53100 -0.23100 1.000 N24 N 1.66900 -3.62600 -0.28000 1.000 C25 C -1.84200 -3.77600 -1.22400 1.000 C26 C -2.94900 -4.60100 -1.24400 1.000 C27 C -3.01400 -5.69300 -0.39900 1.000 C28 C -1.97200 -5.96300 0.46900 1.000 C29 C -0.85900 -5.14500 0.48900 1.000 S30 S 4.30900 0.93000 1.06700 1.000 O31 O 3.26200 1.38900 1.91100 1.000 O32 O 5.47400 0.28000 1.55700 1.000 C33 C 4.86600 2.33300 0.15900 1.000 S34 S 6.45900 2.50200 -0.56800 1.000 C35 C -2.85900 1.06100 -0.25700 1.000 C36 C -4.02400 1.79200 -0.32200 1.000 H37 H 2.03700 0.42100 -1.31700 1.000 H38 H 1.66600 0.58000 0.42200 1.000 H39 H 3.13200 3.54700 0.27000 1.000 H40 H 6.70200 4.73900 -1.74600 1.000 H41 H 4.33000 5.34300 -1.07900 1.000 H42 H -5.75600 0.24600 2.16100 1.000 H43 H -8.60300 5.64600 -1.49500 1.000 H44 H -6.84100 5.78700 -1.28200 1.000 H45 H -7.50500 4.63600 -2.46600 1.000 H46 H -7.86000 4.47800 0.56200 1.000 H47 H -8.52300 3.32700 -0.62200 1.000 H48 H -3.67600 -1.05700 2.26100 1.000 H49 H -1.22800 -1.03500 1.58400 1.000 H50 H 4.29300 -1.05500 -1.76600 1.000 H51 H 5.46700 -1.01200 -0.42900 1.000 H52 H 4.28800 -2.71500 0.78800 1.000 H53 H 4.35400 -3.29100 -0.89800 1.000 H54 H -1.79200 -2.92200 -1.88400 1.000 H55 H -3.76500 -4.39200 -1.92000 1.000 H56 H -3.88100 -6.33700 -0.41600 1.000 H57 H -2.02600 -6.81700 1.12800 1.000 H58 H -0.04300 -5.35900 1.16400 1.000 H59 H -2.04500 1.28500 -0.93000 1.000 H60 H -4.12300 2.59000 -1.04300 1.000