B1WLV8 -OEChem-04022118043D 46 49 0 0 0 0 0 0 0999 V2000 9.6368 1.9509 1.1182 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.1671 1.8837 -0.3799 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4958 2.7325 -1.5086 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7046 2.4393 0.8762 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9794 -2.1234 1.3017 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5381 -2.3457 -0.1216 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1007 0.6860 -0.9141 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6112 -0.1880 -0.2985 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9102 -1.1724 -0.5963 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5841 0.9186 -0.0128 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3875 -0.4021 0.4061 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9564 -0.4893 -0.1322 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0275 -0.9860 0.5163 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8512 1.4875 -0.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5336 -1.1523 0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6354 -1.1196 -0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9699 0.7200 0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8122 -0.5965 0.5916 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7812 -0.4363 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5237 -0.9248 -0.5223 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2594 -1.7461 -0.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6742 0.6291 -0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6307 -1.9903 -0.4074 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0454 0.3848 -0.5628 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0350 -0.4292 -0.1886 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2397 -0.5504 -0.8813 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9442 0.4281 0.9079 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3536 0.1854 -0.4773 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0581 1.1639 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2628 1.0425 0.6194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 0.8238 -1.7257 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9803 2.5156 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4575 -2.1868 1.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9645 1.1462 0.0712 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6861 -1.1962 0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8693 0.7964 -0.3256 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6294 -2.6201 -0.2454 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 1.6541 -0.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0628 -2.4443 1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9927 -3.0149 -0.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7159 1.2325 -0.6741 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1429 -2.0618 -1.0295 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3225 -1.2144 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0255 0.5258 1.4797 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2858 0.0811 -1.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9743 1.8244 2.1713 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 5 13 1 0 0 0 0 5 39 1 0 0 0 0 6 16 2 0 0 0 0 7 12 1 0 0 0 0 7 31 1 0 0 0 0 8 16 1 0 0 0 0 8 19 1 0 0 0 0 8 36 1 0 0 0 0 9 20 1 0 0 0 0 9 25 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 13 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 14 17 1 0 0 0 0 14 32 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 43 1 0 0 0 0 27 29 2 0 0 0 0 27 44 1 0 0 0 0 28 30 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 M END $$$$