mcule 29032406162D 17 18 0 0 0 0 0 0 0 0999 V2000 3.3013 -3.3062 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6321 -2.5630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6539 -2.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3451 -3.7219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9848 -2.0278 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2939 -1.0765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6248 -0.3335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3535 -0.5415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0226 0.2017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7135 1.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2375 1.4617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2375 2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7135 2.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0226 3.7219 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3013 1.9619 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6623 -1.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0068 -2.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 10 15 1 0 0 0 0 8 16 1 0 0 0 0 16 17 1 0 0 0 0 5 17 1 0 0 0 0 M END > MCULE-1172962440 $$$$