BKB5V1 -OEChem-04022107552D 50 53 0 0 0 0 0 0 0999 V2000 8.9282 -0.6496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 -2.1329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 -1.1771 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 0.8470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0679 0.8537 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 1.8229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 0.3229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4641 -0.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6640 0.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5701 0.8576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3301 0.8229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5701 -1.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6640 -0.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1961 -0.6771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1961 0.3229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2000 0.3571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9320 0.3504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0621 -1.1771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3359 0.8604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -0.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4679 0.3637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 -1.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -1.1329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 0.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -1.1262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 0.8738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 0.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5773 1.4775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5773 -1.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1283 -1.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7330 0.6329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8023 1.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0703 1.4737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7521 -1.7140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5991 -1.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3721 -0.6402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3383 1.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7318 -0.9550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9322 0.6758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3258 -1.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8670 2.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7931 2.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 0.6783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -1.7462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 1.4938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -0.9308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 0.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 24 2 0 0 0 0 3 8 2 0 0 0 0 3 14 1 0 0 0 0 4 9 1 0 0 0 0 4 18 1 0 0 0 0 4 35 1 0 0 0 0 5 16 1 0 0 0 0 5 18 1 0 0 0 0 5 36 1 0 0 0 0 6 11 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 31 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 34 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 2 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M END $$$$