mcule 28032417072D 22 24 0 0 0 0 0 0 0 0999 V2000 -0.8466 -0.6049 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.3089 -1.4758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2722 -1.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5253 -2.7002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8167 -3.4027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8536 -3.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5973 -2.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -1.6246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7244 -0.7528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6948 -0.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5253 -1.1143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7936 0.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8744 0.8803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6348 1.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7294 2.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0951 3.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1031 3.4027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6692 2.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7679 1.7757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1317 1.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2208 0.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7598 0.3149 0.0000 O 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 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 2 7 2 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 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 9 21 1 0 0 0 0 21 22 2 0 0 0 0 M END > P-5180191 $$$$