-ISIS- 08251614012D 41 45 0 0 0 0 0 0 0 0999 V2000 1.8542 1.6125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.8250 0.6458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6792 -0.4167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3792 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2917 1.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9292 1.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8792 -1.0250 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.8542 0.3542 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3458 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7125 1.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1083 -0.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6875 2.1125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 0.0458 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0458 1.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1083 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6583 2.9792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8458 -2.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9958 3.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2958 1.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0125 1.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7417 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0667 3.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4125 2.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 1.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3792 2.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2917 3.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 2.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6792 1.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4417 2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8167 4.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 3.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7125 -2.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9417 -2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0458 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1625 1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 3.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7125 4.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6917 3.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6792 -3.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9042 -3.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -4.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 9 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 6 1 1 0 0 0 0 7 11 1 0 0 0 0 8 2 1 0 0 0 0 9 4 1 0 0 0 0 10 5 2 0 0 0 0 11 4 2 0 0 0 0 12 1 1 0 0 0 0 13 2 2 0 0 0 0 14 9 1 0 0 0 0 15 19 1 0 0 0 0 16 6 2 0 0 0 0 17 7 1 0 0 0 0 18 22 1 0 0 0 0 19 23 2 0 0 0 0 20 14 1 0 0 0 0 21 14 2 0 0 0 0 22 26 2 0 0 0 0 23 24 1 0 0 0 0 24 12 1 0 0 0 0 25 29 2 0 0 0 0 26 23 1 0 0 0 0 27 15 1 0 0 0 0 28 20 2 0 0 0 0 29 21 1 0 0 0 0 30 18 1 0 0 0 0 31 25 1 0 0 0 0 32 17 2 0 0 0 0 33 17 1 0 0 0 0 34 31 1 0 0 0 0 35 27 1 0 0 0 0 36 30 1 0 0 0 0 37 34 1 0 0 0 0 38 37 1 0 0 0 0 39 32 1 0 0 0 0 40 33 2 0 0 0 0 41 40 1 0 0 0 0 8 5 1 0 0 0 0 15 18 2 0 0 0 0 7 3 1 0 0 0 0 28 25 1 0 0 0 0 39 41 2 0 0 0 0 M END