-ISIS- 08251614012D 31 34 0 0 0 0 0 0 0 0999 V2000 -2.2125 -0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8167 0.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -1.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7917 -1.2708 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7458 0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2125 -0.4542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7042 -1.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7375 -0.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.4375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -0.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5125 1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8083 -2.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2958 -1.3000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7792 1.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 0.4375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1958 -2.1958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -2.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1833 2.0417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2917 0.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 1.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -3.0500 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5333 1.5167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6917 0.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 0.4583 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6917 -1.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2833 -0.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2667 2.1667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2625 2.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2333 2.4708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 3.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7583 3.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 7 1 0 0 0 0 4 1 1 0 0 0 0 5 2 1 0 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 8 4 1 0 0 0 0 9 3 1 0 0 0 0 10 9 2 0 0 0 0 11 2 1 0 0 0 0 12 3 2 0 0 0 0 13 17 2 0 0 0 0 14 19 1 0 0 0 0 15 10 1 0 0 0 0 16 7 2 0 0 0 0 17 12 1 0 0 0 0 18 11 2 0 0 0 0 19 15 1 0 0 0 0 20 14 2 0 0 0 0 21 12 1 0 0 0 0 22 11 1 0 0 0 0 23 5 1 0 0 0 0 24 20 1 0 0 0 0 25 8 1 0 0 0 0 26 25 1 0 0 0 0 27 14 1 0 0 0 0 28 20 1 0 0 0 0 29 22 1 0 0 0 0 30 27 2 0 0 0 0 31 30 1 0 0 0 0 5 8 2 0 0 0 0 26 23 1 0 0 0 0 10 13 1 0 0 0 0 31 28 2 0 0 0 0 M END