B9TBA7 -OEChem-04012112552D 41 40 0 0 0 0 0 0 0999 V2000 7.4040 4.7200 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1.4030 5.0369 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 6.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 5.0369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.5369 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1350 8.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 9.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 9.4030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 7.6709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 2.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 1.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 2.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 3.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 3.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 8.6195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5244 7.9293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1771 8.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 9.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5571 9.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0380 9.7130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 9.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9641 9.0930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9641 7.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 7.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 7.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3471 6.4543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7456 7.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 0.4543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0135 1.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 2.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 2.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 3.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 3.8469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 1.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.2269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 19 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 16 18 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 M CHG 2 1 -1 5 1 M END $$$$