# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0ND' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy B0 B 3.74900 2.08000 0.54400 1.000 O1 O 3.13600 3.17800 -0.11700 1.000 O2 O 5.15200 2.07500 0.75900 1.000 C3 C 2.87300 0.87700 1.04300 1.000 N4 N 2.87600 -0.18200 0.03000 1.000 S5 S 1.93100 -1.52600 0.23400 1.000 O6 O 2.10200 -2.31900 -0.93300 1.000 O7 O 2.19500 -2.00700 1.54500 1.000 C8 C 0.25200 -0.99000 0.22900 1.000 C9 C -0.52000 -1.13400 1.36700 1.000 C10 C -1.83400 -0.71100 1.37200 1.000 C11 C -2.38300 -0.13700 0.22500 1.000 C12 C -3.79100 0.31900 0.22400 1.000 N13 N -4.45200 0.89200 -0.81200 1.000 N14 N -5.74800 1.14400 -0.32900 1.000 N15 N -5.77800 0.73100 0.89200 1.000 N16 N -4.64000 0.24100 1.22700 1.000 C17 C -1.59900 0.00700 -0.92000 1.000 C18 C -0.28700 -0.42100 -0.91200 1.000 Cl19 Cl 0.69200 -0.23700 -2.33400 1.000 H20 H 2.19200 3.05800 -0.28600 1.000 H21 H 5.60500 2.85900 0.42100 1.000 H22 H 3.28500 0.48900 1.97400 1.000 H23 H 1.85000 1.21600 1.21000 1.000 H24 H 3.43100 -0.09500 -0.76100 1.000 H25 H -0.09400 -1.57800 2.25500 1.000 H26 H -2.43600 -0.82400 2.26100 1.000 H27 H -4.10500 1.08600 -1.69700 1.000 H28 H -2.01900 0.45000 -1.81100 1.000