BNU40H -OEChem-04022105523D 27 28 0 0 0 0 0 0 0999 V2000 -2.4784 -3.4822 -0.2130 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -0.1519 -0.4834 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0544 2.0337 -0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2904 2.4404 0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2085 0.2114 -0.2218 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0984 -1.0259 -0.1668 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5166 0.1971 -0.1079 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7662 0.7221 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5432 1.1239 0.1361 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7927 -1.1772 -0.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7081 -1.9846 0.9497 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8408 0.6360 0.2704 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0985 -1.6372 -0.0742 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1235 -0.7293 0.1675 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0055 2.8238 0.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2913 0.7451 0.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5721 0.8844 -1.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -0.7102 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0599 -1.5589 -1.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6826 -0.9125 -1.1323 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0029 -1.9022 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7301 -1.4831 1.9225 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7053 -2.3951 0.7958 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4098 -2.8241 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6609 1.3260 0.4601 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1518 -1.0635 0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1916 3.8857 0.1776 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 5 1 0 0 0 0 2 8 1 0 0 0 0 2 20 1 0 0 0 0 3 8 2 0 0 0 0 3 15 1 0 0 0 0 4 9 1 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 9 12 1 0 0 0 0 10 13 2 0 0 0 0 10 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$