B1KG5I -OEChem-04042102173D 27 29 0 0 0 0 0 0 0999 V2000 -6.0651 -0.9431 0.5113 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0972 -1.0332 0.5294 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5496 2.6118 1.3956 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7416 2.8708 -0.8545 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2426 -1.1407 -0.1331 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9901 -0.2420 -0.0129 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0905 -1.3254 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4594 1.0544 0.0289 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7143 0.1264 -0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 1.2479 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1488 0.2314 -0.1349 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3759 -0.4713 0.0253 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6183 -2.6130 -0.1364 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8763 -1.7696 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.8415 -0.0984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 1.2433 -0.6499 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2984 2.2462 0.1109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3252 0.9765 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5549 -0.2289 0.1289 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3307 2.2498 0.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0885 0.3474 0.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9498 -3.4696 -0.1998 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9476 -1.9433 0.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3777 -3.8578 -0.1322 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5426 2.1363 -1.1214 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 1.6391 -0.8329 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1138 3.4130 1.4438 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 11 1 0 0 0 0 2 19 1 0 0 0 0 3 17 1 0 0 0 0 3 27 1 0 0 0 0 4 17 2 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 13 2 0 0 0 0 8 10 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 20 1 0 0 0 0 11 16 2 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 M END $$$$