B1N5PB -OEChem-04022107523D 27 29 0 0 0 0 0 0 0999 V2000 -3.8494 -1.2717 -1.1299 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3854 -0.4332 0.8934 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8607 1.5074 -0.5443 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9194 0.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9616 -2.0362 -0.0413 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8527 -0.1767 1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1678 0.5747 0.4398 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3292 0.2870 -0.2384 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -0.0926 0.6299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -1.6958 0.5941 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -1.0411 -0.5247 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3422 1.1346 0.0763 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7069 -1.2431 0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0039 2.4558 -0.0438 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4075 1.2128 -0.8208 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7723 -1.1647 -0.5946 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1226 0.0633 -1.1561 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 -0.9713 2.3309 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7925 0.7438 2.1935 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2204 -2.5001 0.9689 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7213 1.6831 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7999 2.0395 0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4434 -2.2048 0.7333 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1978 3.5131 -0.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6814 2.1691 -1.2567 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3292 -2.0597 -0.8558 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9524 0.1241 -1.8541 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 8 1 0 0 0 0 3 14 1 0 0 0 0 3 21 1 0 0 0 0 4 7 1 0 0 0 0 4 14 2 0 0 0 0 5 10 2 0 0 0 0 5 11 1 0 0 0 0 6 9 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 20 1 0 0 0 0 12 15 1 0 0 0 0 12 22 1 0 0 0 0 13 16 2 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 M END $$$$