# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0JM' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O -4.14700 -2.14800 1.15100 1.000 C1 C -4.05800 -1.02000 0.42900 1.000 O2 O -5.05100 -0.54100 -0.06600 1.000 C3 C -2.72100 -0.35200 0.23500 1.000 C4 C -1.96100 -1.09200 -0.87500 1.000 C5 C -2.82700 -2.20400 -1.47000 1.000 C6 C -0.65000 -1.66700 -0.33500 1.000 S7 S -1.62600 0.20500 -2.12500 1.000 N8 N -2.94400 1.06100 -0.04200 1.000 C9 C -2.00800 1.62900 -1.03900 1.000 C10 C -2.26600 1.90100 0.96600 1.000 O11 O -2.80600 3.22000 1.06500 1.000 C12 C -1.00100 1.81900 0.10000 1.000 N13 N -0.16600 0.64500 0.36600 1.000 C14 C 1.15200 0.67900 0.08700 1.000 O15 O 1.65600 1.69600 -0.34100 1.000 C16 C 2.00100 -0.54700 0.30600 1.000 C17 C 2.01700 -0.89000 1.77400 1.000 O18 O 2.71400 -1.95200 2.20700 1.000 O19 O 1.40400 -0.20900 2.56100 1.000 C20 C 3.40700 -0.27600 -0.16200 1.000 C21 C 3.96200 -1.04800 -1.16500 1.000 C22 C 4.14000 0.74900 0.40700 1.000 C23 C 5.42900 0.99800 -0.02300 1.000 C24 C 5.98700 0.22200 -1.02200 1.000 C25 C 5.25200 -0.79900 -1.59500 1.000 H26 H -5.02500 -2.54000 1.24800 1.000 H27 H -2.15400 -0.43700 1.16200 1.000 H28 H -3.73500 -1.77100 -1.89100 1.000 H29 H -2.27200 -2.71700 -2.25500 1.000 H30 H -3.09300 -2.91500 -0.68800 1.000 H31 H -0.74900 -1.85500 0.73400 1.000 H32 H -0.42400 -2.60200 -0.84800 1.000 H33 H 0.15700 -0.95500 -0.50600 1.000 H34 H -2.33700 2.52900 -1.55900 1.000 H35 H -2.16100 1.41500 1.93600 1.000 H36 H -2.36800 3.77700 1.72300 1.000 H37 H -0.43500 2.75000 0.04600 1.000 H38 H -0.56200 -0.15600 0.74300 1.000 H39 H 1.58500 -1.38200 -0.25700 1.000 H40 H 2.69500 -2.13200 3.15700 1.000 H41 H 3.38800 -1.84600 -1.61300 1.000 H42 H 3.70400 1.35500 1.18700 1.000 H43 H 6.00200 1.79900 0.42100 1.000 H44 H 6.99500 0.41700 -1.35800 1.000 H45 H 5.68600 -1.40300 -2.37900 1.000