BGD8U4 -OEChem-04022100362D 54 57 0 0 0 0 0 0 0999 V2000 9.8622 -0.4330 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.4330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.9330 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5321 -1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3622 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3622 1.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.3984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.4677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0382 2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4182 3.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8991 3.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0522 3.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8252 3.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8252 1.3910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6722 1.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8991 2.0110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 3.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 2.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 1.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7875 0.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.2216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -3.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -3.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.2659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -3.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -2.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 3 23 2 0 0 0 0 4 5 1 0 0 0 0 4 22 2 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 28 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 28 2 0 0 0 0 8 31 2 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 13 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 17 1 0 0 0 0 14 41 1 0 0 0 0 15 18 2 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 24 2 0 0 0 0 21 23 1 0 0 0 0 21 25 2 0 0 0 0 22 47 1 0 0 0 0 24 26 1 0 0 0 0 24 48 1 0 0 0 0 25 27 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 M CHG 1 4 1 M END $$$$