-ISIS- 08251614012D 21 22 0 0 0 0 0 0 0 0999 V2000 2.2417 0.3750 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.1417 -0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3333 0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 0.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -0.8375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5083 -1.0958 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2667 0.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4917 -1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8458 -1.2792 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8542 -0.1417 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.1250 -1.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 1.7917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2125 0.9167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9167 -0.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9083 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1375 -2.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1333 -2.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -1.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2333 1.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 0.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 2.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 3 1 0 0 0 0 5 2 1 0 0 0 0 6 8 1 0 0 0 0 7 4 2 0 0 0 0 8 15 1 0 0 0 0 9 2 2 0 0 0 0 10 6 1 0 0 0 0 11 6 2 0 0 0 0 12 3 2 0 0 0 0 13 1 1 0 0 0 0 14 7 1 0 0 0 0 15 14 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 14 1 0 0 0 0 19 13 1 0 0 0 0 20 13 1 0 0 0 0 21 19 1 0 0 0 0 4 5 1 0 0 0 0 8 16 2 0 0 0 0 M CHG 2 6 1 10 -1 M END