D00423 -OEChem-05072121512D 40 42 0 1 0 0 0 0 0999 V2000 3.4022 1.4642 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -0.5841 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 -1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9056 -1.4482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8989 0.2799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5381 -1.0875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 0.9400 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0663 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0663 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6644 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6644 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 1.4747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 -0.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6644 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2663 0.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3964 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3353 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9323 2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9744 0.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2013 1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3544 1.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 -1.2146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 2.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5304 -2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4884 -1.5231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2614 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1084 -2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9334 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9334 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5405 -1.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 17 1 0 0 0 0 3 12 2 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 26 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 14 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 16 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 13 18 1 0 0 0 0 13 20 2 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 19 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 20 23 1 0 0 0 0 20 32 1 0 0 0 0 21 24 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$