BF28OQ -OEChem-04022101522D 42 45 0 0 0 0 0 0 0999 V2000 2.0000 2.9470 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9470 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.4470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 0.0810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.8130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -1.5530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -0.7482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -2.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 -0.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 -2.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -0.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -2.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 9 1 0 0 0 0 2 15 1 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 6 19 2 0 0 0 0 7 10 1 0 0 0 0 7 19 1 0 0 0 0 7 29 1 0 0 0 0 8 11 1 0 0 0 0 8 19 1 0 0 0 0 8 30 1 0 0 0 0 9 13 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 13 18 2 0 0 0 0 13 21 1 0 0 0 0 14 18 1 0 0 0 0 14 22 2 0 0 0 0 15 24 2 0 0 0 0 15 25 1 0 0 0 0 16 20 2 0 0 0 0 16 32 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 24 26 1 0 0 0 0 24 39 1 0 0 0 0 25 27 2 0 0 0 0 25 40 1 0 0 0 0 26 28 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 M END $$$$