# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0M3' 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 -5.14400 4.71800 -0.93000 1.000 C1 C -5.21800 3.22600 -0.72700 1.000 C2 C -5.56000 2.40100 -1.78200 1.000 C3 C -5.62800 1.03300 -1.59600 1.000 C4 C -5.35400 0.49000 -0.35500 1.000 C5 C -5.01100 1.31500 0.70000 1.000 C6 C -4.93700 2.68300 0.51200 1.000 S7 S -5.44200 -1.25300 -0.11700 1.000 O8 O -5.66400 -1.45900 1.27100 1.000 O9 O -6.30900 -1.75300 -1.12600 1.000 N10 N -3.94000 -1.86900 -0.44600 1.000 C11 C -2.80000 -1.51300 0.40300 1.000 C12 C -2.60500 -2.58800 1.47400 1.000 N13 N -1.45000 -2.24100 2.31200 1.000 C14 C -0.21500 -2.19000 1.51900 1.000 C15 C -0.33900 -1.10300 0.44900 1.000 C16 C -1.53500 -1.41700 -0.45400 1.000 C17 C 0.92000 -1.06600 -0.37800 1.000 O18 O 0.86700 -1.26600 -1.57300 1.000 N19 N 2.10600 -0.80900 0.21000 1.000 C20 C 3.33000 -0.77300 -0.59400 1.000 C21 C 4.52500 -0.46400 0.31000 1.000 C22 C 5.79700 -0.54700 -0.49300 1.000 C23 C 6.84300 -1.33700 -0.05200 1.000 C24 C 8.01000 -1.41300 -0.78900 1.000 C25 C 8.13100 -0.70100 -1.96800 1.000 C26 C 7.08500 0.08800 -2.40900 1.000 C27 C 5.91600 0.16100 -1.67400 1.000 C28 C 4.37900 0.92400 0.87800 1.000 C29 C 4.14200 1.99400 0.03600 1.000 C30 C 4.00900 3.26800 0.55700 1.000 C31 C 4.11300 3.47100 1.92000 1.000 C32 C 4.34900 2.40100 2.76300 1.000 C33 C 4.47800 1.12700 2.24200 1.000 H34 H -6.11800 5.16100 -0.72300 1.000 H35 H -4.40100 5.14000 -0.25400 1.000 H36 H -4.86000 4.93100 -1.96100 1.000 H37 H -5.77500 2.82600 -2.75200 1.000 H38 H -5.89600 0.38900 -2.42000 1.000 H39 H -4.79700 0.89100 1.67000 1.000 H40 H -4.66900 3.32700 1.33700 1.000 H41 H -3.81500 -2.46600 -1.20000 1.000 H42 H -2.99000 -0.55200 0.88200 1.000 H43 H -3.49900 -2.64800 2.09500 1.000 H44 H -2.43000 -3.55100 0.99500 1.000 H45 H -1.60400 -1.37000 2.79800 1.000 H46 H 0.62700 -1.96200 2.17300 1.000 H47 H -0.05100 -3.15500 1.04000 1.000 H48 H -0.48900 -0.13600 0.92900 1.000 H49 H -1.36700 -2.36600 -0.96300 1.000 H50 H -1.65300 -0.62300 -1.19100 1.000 H51 H 2.14800 -0.64900 1.16600 1.000 H52 H 3.47800 -1.74000 -1.07400 1.000 H53 H 3.24100 0.00200 -1.35600 1.000 H54 H 4.56100 -1.18800 1.12400 1.000 H55 H 6.74800 -1.89300 0.86800 1.000 H56 H 8.82700 -2.02900 -0.44400 1.000 H57 H 9.04300 -0.76000 -2.54300 1.000 H58 H 7.18000 0.64500 -3.33000 1.000 H59 H 5.09800 0.77400 -2.02200 1.000 H60 H 4.06200 1.83600 -1.03000 1.000 H61 H 3.82500 4.10400 -0.10100 1.000 H62 H 4.00900 4.46600 2.32700 1.000 H63 H 4.43000 2.55900 3.82800 1.000 H64 H 4.65900 0.29000 2.90000 1.000