B9HEW1 -OEChem-04012115402D 57 61 0 1 0 0 0 0 0999 V2000 13.9414 2.8282 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.3281 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3671 0.5379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 -1.1942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.8282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.8281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.6719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.1719 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.3312 -1.3282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.1719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0094 -0.0234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0094 -1.6329 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5930 -0.8281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.1719 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4651 1.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.8281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3201 0.9271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2986 1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6093 2.0838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9664 0.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5878 2.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9450 0.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2556 1.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 0.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0757 1.0642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6772 1.7545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 -0.8031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 -0.8031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9976 2.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2006 2.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 1.7545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1225 1.0642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -2.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2995 1.5468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7063 1.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7738 -0.2003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7804 2.8794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3590 0.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8623 1.6736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 8 1 0 0 0 0 2 20 1 0 0 0 0 5 22 2 0 0 0 0 6 31 1 0 0 0 0 6 57 1 0 0 0 0 7 31 2 0 0 0 0 8 16 1 0 0 0 0 8 18 1 0 0 0 0 9 19 1 0 0 0 0 9 22 1 0 0 0 0 9 46 1 0 0 0 0 10 19 2 0 0 0 0 10 21 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 14 37 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 20 24 1 0 0 0 0 20 25 2 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 24 27 2 0 0 0 0 24 47 1 0 0 0 0 25 28 1 0 0 0 0 25 48 1 0 0 0 0 26 30 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 30 32 1 0 0 0 0 30 33 2 0 0 0 0 32 34 2 0 0 0 0 33 35 1 0 0 0 0 33 53 1 0 0 0 0 34 36 1 0 0 0 0 34 54 1 0 0 0 0 35 36 2 0 0 0 0 35 55 1 0 0 0 0 36 56 1 0 0 0 0 M END $$$$