BD5A7L -OEChem-04022102472D 43 46 0 1 0 0 0 0 0999 V2000 4.3709 2.4353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.0763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -2.7851 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.7619 -3.6512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.6790 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -2.7851 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6783 1.4837 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 1.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4883 2.0701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 0.6790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4011 1.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3855 3.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.1871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -1.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2112 2.2482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1955 3.6512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1084 3.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -1.0531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -1.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -1.9191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 0.8910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 1.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7647 2.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4649 1.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8195 3.3179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 0.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6419 -1.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7771 1.9950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1318 4.2679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6106 3.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8819 -1.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -2.4560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 32 1 0 0 0 0 2 10 2 0 0 0 0 3 6 1 0 0 0 0 4 6 2 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 18 1 0 0 0 0 13 30 1 0 0 0 0 14 19 1 0 0 0 0 14 31 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 16 33 1 0 0 0 0 17 23 2 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 25 1 0 0 0 0 20 37 1 0 0 0 0 21 26 2 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 M CHG 2 3 -1 6 1 M END $$$$