BJ5PE2 -OEChem-04012118262D 41 44 0 1 0 0 0 0 0999 V2000 5.9209 3.7406 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 2.2520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5763 -2.6558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.6710 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.8663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.8662 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1338 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -2.8277 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3758 -3.7406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7094 -2.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -2.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3701 -3.6343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.0952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 2.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 2.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5781 -3.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7864 -3.9332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5057 -4.3468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 -1.6551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 -1.7432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -2.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -3.2412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3712 -4.2543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9868 -3.6980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1423 -2.4026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 0.6338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 1.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.4438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.4438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2177 3.0453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 2.8413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 22 1 0 0 0 0 2 41 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 16 2 0 0 0 0 6 14 2 0 0 0 0 6 19 1 0 0 0 0 7 18 1 0 0 0 0 7 19 2 0 0 0 0 8 18 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 25 1 0 0 0 0 10 13 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 17 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$