# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0RK' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Cl0 Cl -7.05300 3.20900 -0.61400 1.000 C1 C -5.45700 2.53100 -0.53800 1.000 C2 C -5.18600 1.49600 0.34100 1.000 C3 C -4.45700 3.02200 -1.35900 1.000 C4 C -3.18600 2.48300 -1.30000 1.000 C5 C -2.91200 1.45000 -0.41700 1.000 O6 O -1.66300 0.91900 -0.35700 1.000 C7 C -0.68000 1.47400 -1.23300 1.000 C8 C -3.91700 0.95600 0.40300 1.000 S9 S -3.57200 -0.35700 1.52600 1.000 O10 O -2.38500 0.00800 2.21800 1.000 O11 O -4.79600 -0.65400 2.18500 1.000 N12 N -3.19400 -1.69100 0.62000 1.000 C13 C -4.16100 -2.68100 0.14000 1.000 C14 C -3.33000 -3.71100 -0.64200 1.000 C15 C -1.90700 -3.20700 -0.54100 1.000 C16 C -1.90800 -2.03300 0.19800 1.000 C17 C -0.72800 -3.72100 -1.05000 1.000 C18 C -0.75100 -4.99400 -1.85500 1.000 C19 C 0.46900 -3.07400 -0.82400 1.000 C20 C 0.48800 -1.89400 -0.07700 1.000 C21 C -0.70100 -1.37100 0.42400 1.000 C22 C 1.76600 -1.19400 0.16900 1.000 O23 O 1.78100 -0.16800 0.82000 1.000 N24 N 2.91500 -1.69500 -0.32600 1.000 C25 C 4.10300 -0.98000 -0.18900 1.000 C26 C 4.08300 0.41000 -0.21700 1.000 C27 C 5.25600 1.12000 -0.08200 1.000 Cl28 Cl 5.23100 2.85600 -0.11700 1.000 C29 C 5.30600 -1.66000 -0.01800 1.000 C30 C 6.48200 -0.95800 0.11900 1.000 C31 C 6.46800 0.44000 0.08500 1.000 C32 C 7.72500 1.19500 0.23100 1.000 O33 O 8.89000 0.53800 0.39700 1.000 O34 O 7.71200 2.41000 0.20100 1.000 H35 H -5.96900 1.11200 0.97800 1.000 H36 H -4.67100 3.82700 -2.04700 1.000 H37 H -2.40700 2.86600 -1.94200 1.000 H38 H 0.27100 0.96100 -1.08500 1.000 H39 H -1.00200 1.34800 -2.26700 1.000 H40 H -0.55800 2.53500 -1.01700 1.000 H41 H -4.66100 -3.16100 0.98200 1.000 H42 H -4.89200 -2.20900 -0.51600 1.000 H43 H -3.41700 -4.69700 -0.18500 1.000 H44 H -3.64800 -3.74400 -1.68400 1.000 H45 H -0.88900 -4.75500 -2.91000 1.000 H46 H 0.19200 -5.52500 -1.72400 1.000 H47 H -1.57300 -5.62400 -1.51500 1.000 H48 H 1.38800 -3.47800 -1.22300 1.000 H49 H -0.68700 -0.45800 1.00000 1.000 H50 H 2.91500 -2.55300 -0.77900 1.000 H51 H 3.14800 0.93400 -0.34600 1.000 H52 H 5.31700 -2.73900 0.00900 1.000 H53 H 7.41400 -1.48600 0.25200 1.000 H54 H 9.68900 1.07600 0.48800 1.000