MMs02589208 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7529 -1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2528 -1.2941 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6528 -0.2549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0057 -2.5915 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8057 -2.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2586 -3.8922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0114 -5.1896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5057 -2.5882 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -3.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9296 -5.2274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8156 -3.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0311 -4.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 -3.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6155 -4.4780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9845 -3.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1380 -2.3728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5070 -1.7597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7224 -2.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5689 -4.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1999 -4.7439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8123 -1.8331 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3847 -1.3727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 0.0528 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0379 0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3739 -1.7103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9638 -2.4787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0405 -0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5977 1.0471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9594 0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9082 -5.4058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5228 -2.4053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4927 -5.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1656 -1.6696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6298 -0.5660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8176 -2.1482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5413 -4.8340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0771 -5.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7586 -3.8955 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M CHG 1 42 -1 M END