L1IWD3 -OEChem-05022323442D 51 54 0 1 0 0 0 0 0999 V2000 11.2229 0.5956 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.1346 0.7369 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4843 1.8206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4386 2.7061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -1.0237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 -2.6332 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0868 3.2384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -0.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3972 1.4123 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 -2.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6743 1.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6726 0.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7238 1.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2072 1.9986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 0.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1201 1.5903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1044 2.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4164 2.4964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9301 2.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9144 3.5797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8273 3.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8950 1.0487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1735 -0.1311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6139 -1.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.4484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8833 0.3538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5637 -0.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1167 0.4813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5384 3.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4960 1.9236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8507 4.1964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3295 3.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8963 3.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6931 3.1085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.7915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.8654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -3.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -3.8284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 11 1 0 0 0 0 2 18 1 0 0 0 0 12 3 1 1 0 0 0 3 14 1 0 0 0 0 4 21 1 0 0 0 0 4 30 1 0 0 0 0 5 22 1 0 0 0 0 5 31 1 0 0 0 0 6 26 2 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 17 1 0 0 0 0 8 13 1 0 0 0 0 8 17 2 0 0 0 0 9 26 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 11 15 2 0 0 0 0 12 19 1 0 0 0 0 12 23 1 0 0 0 0 12 32 1 0 0 0 0 13 20 2 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 33 1 0 0 0 0 16 21 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 26 1 0 0 0 0 19 24 1 0 0 0 0 19 25 2 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 27 2 0 0 0 0 25 28 1 0 0 0 0 25 40 1 0 0 0 0 27 29 1 0 0 0 0 27 41 1 0 0 0 0 28 29 2 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END $$$$