Amb1939813 OpenBabel05162510152D 27 29 0 0 1 0 0 0 0 0999 V2000 2.4351 3.7111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1261 2.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8171 1.8090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4049 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4049 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9049 0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4049 -0.7321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9049 0.1340 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4049 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4049 -0.7321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9927 0.0770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9437 -0.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9437 -1.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9927 -1.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7527 -1.8198 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4049 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8171 0.1910 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 0.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2321 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2321 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 2 3 1 0 0 0 0 3 19 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 10 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 17 18 1 0 0 0 0 18 23 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M END > www.ambinter.com > Amb1939813 > 449.408 $$$$