-ISIS- 11270914432D 50 53 0 0 0 0 0 0 0 0999 V2000 1.8542 -2.8042 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.8917 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -2.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2458 -3.6250 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.3000 -2.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6042 -2.8875 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.2167 -2.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0667 -1.6667 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -1.6542 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7125 -1.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8792 -1.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4667 -2.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0375 -2.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3542 -0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3167 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0542 -1.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5167 -1.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4667 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1792 -0.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9583 -4.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8333 -4.3417 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.4542 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0292 -2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5333 -3.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 -2.9125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -2.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7042 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9583 -4.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6708 -3.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.0417 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6750 -0.3250 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6875 -3.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7625 -1.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3417 -1.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6708 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3833 -4.0417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3833 -4.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3292 -5.3625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -3.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3417 0.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0375 -4.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0958 -5.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8042 -1.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.7667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3208 -4.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0167 -4.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0375 -4.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 14 2 0 0 0 0 3 1 2 0 0 0 0 5 1 1 0 0 0 0 6 2 1 0 0 0 0 7 6 1 0 0 0 0 8 2 1 0 0 0 0 9 3 1 0 0 0 0 10 5 2 0 0 0 0 11 8 1 0 0 0 0 12 5 1 0 0 0 0 13 7 1 0 0 0 0 14 24 1 0 0 0 0 15 11 1 0 0 0 0 16 10 1 0 0 0 0 17 3 1 0 0 0 0 18 12 2 0 0 0 0 19 13 2 0 0 0 0 20 18 1 0 0 0 0 21 15 2 0 0 0 0 22 4 1 0 0 0 0 23 4 1 0 0 0 0 24 28 2 0 0 0 0 25 17 2 0 0 0 0 26 4 2 0 0 0 0 27 4 2 0 0 0 0 28 25 1 0 0 0 0 29 1 1 0 0 0 0 30 22 1 0 0 0 0 31 22 2 0 0 0 0 32 20 1 0 0 0 0 33 21 1 0 0 0 0 34 6 1 0 0 0 0 35 18 1 0 0 0 0 36 19 1 0 0 0 0 37 30 2 0 0 0 0 38 31 1 0 0 0 0 39 38 2 0 0 0 0 40 44 1 0 0 0 0 41 28 1 0 0 0 0 42 33 1 0 0 0 0 43 32 1 0 0 0 0 44 50 1 0 0 0 0 45 39 1 0 0 0 0 46 36 1 0 0 0 0 47 35 1 0 0 0 0 48 29 1 0 0 0 0 49 34 1 0 0 0 0 50 41 1 0 0 0 0 10 9 1 0 0 0 0 20 16 2 0 0 0 0 7 11 2 0 0 0 0 21 19 1 0 0 0 0 37 39 1 0 0 0 0 M CHG 2 1 1 23 -1 M END