-ISIS- 11270914432D 22 23 0 0 0 0 0 0 0 0999 V2000 -0.0958 1.3333 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 -0.8583 0.9958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6667 1.6708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3667 2.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4333 2.0958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2417 0.5708 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9458 0.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6042 2.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4667 3.3208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9417 2.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5167 1.3583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3375 1.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0292 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0917 1.5125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7542 1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1875 2.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7958 -0.9875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 1.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2833 1.1458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3708 0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -1.4667 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 8 1 0 0 0 0 5 1 2 0 0 0 0 6 1 2 0 0 0 0 7 2 2 0 0 0 0 8 10 1 0 0 0 0 9 4 2 0 0 0 0 10 17 2 0 0 0 0 11 16 1 0 0 0 0 12 3 1 0 0 0 0 13 7 1 0 0 0 0 14 4 1 0 0 0 0 15 12 1 0 0 0 0 16 15 2 0 0 0 0 17 15 1 0 0 0 0 18 13 1 0 0 0 0 19 2 1 0 0 0 0 20 19 2 0 0 0 0 21 20 1 0 0 0 0 22 18 1 0 0 0 0 13 21 2 0 0 0 0 11 8 2 0 0 0 0 M END