B5P8KS -OEChem-04022102342D 42 45 0 0 0 0 0 0 0999 V2000 3.8000 4.3080 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.8875 -4.3080 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.5026 -3.1865 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 2.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.1920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.3080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -1.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.1573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -2.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3116 -1.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 3.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 3.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 -2.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 4.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4808 -3.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 2.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -0.3820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 0.4626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.8466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 0.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.3591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.0249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4405 -1.1788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1291 2.4980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 4.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5974 -2.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 4.9280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4401 2.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 3.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8201 3.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 27 1 0 0 0 0 3 16 1 0 0 0 0 3 27 1 0 0 0 0 4 13 2 0 0 0 0 5 20 1 0 0 0 0 5 28 1 0 0 0 0 6 10 1 0 0 0 0 6 11 2 0 0 0 0 7 13 1 0 0 0 0 7 17 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 2 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 29 1 0 0 0 0 14 18 1 0 0 0 0 14 30 1 0 0 0 0 15 19 1 0 0 0 0 15 31 1 0 0 0 0 16 21 2 0 0 0 0 17 20 2 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 23 1 0 0 0 0 21 25 1 0 0 0 0 21 35 1 0 0 0 0 22 24 2 0 0 0 0 22 36 1 0 0 0 0 23 26 2 0 0 0 0 23 37 1 0 0 0 0 24 26 1 0 0 0 0 25 27 2 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$