BB82AE -OEChem-04042105373D 31 33 0 0 0 0 0 0 0999 V2000 5.1646 -0.3041 2.1642 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.4114 -3.3408 0.1132 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5768 3.3420 0.2015 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.2461 1.2516 0.2327 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3583 -4.3011 -0.0589 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3619 -0.8120 0.0572 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3373 2.1122 0.1688 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2663 -0.0633 -0.1019 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6005 0.3340 0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7329 0.9277 -0.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2543 -1.4862 -0.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9869 1.6783 0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5572 -1.9171 -0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 0.5346 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3612 2.2764 -0.1255 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9784 2.6436 -0.0144 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8825 0.3292 0.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6884 0.3584 -1.5473 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0466 -3.2591 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2194 -0.0525 0.7485 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0253 -0.0230 -1.6597 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7909 -0.2288 -0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6148 -2.1263 -0.1957 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3693 -0.8335 0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1176 3.0570 -0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2005 3.7082 0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4387 0.4659 1.8453 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1057 0.5139 -2.4523 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4703 -0.1603 -2.6409 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8314 -0.5258 -0.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7177 -4.2727 0.1286 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 19 1 0 0 0 0 2 31 1 0 0 0 0 3 7 1 0 0 0 0 4 7 2 0 0 0 0 5 19 2 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 6 24 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 13 2 0 0 0 0 11 23 1 0 0 0 0 12 16 1 0 0 0 0 13 19 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 20 1 0 0 0 0 17 27 1 0 0 0 0 18 21 2 0 0 0 0 18 28 1 0 0 0 0 20 22 2 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 30 1 0 0 0 0 M CHG 2 3 -1 7 1 M END $$$$