MMs01457772 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.3199 -1.4655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7893 -2.4753 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9268 -1.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8042 -0.0024 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2083 -2.2770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8629 -3.7366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8407 -4.8741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3679 -3.8592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5922 -1.6984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7852 -2.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5943 -4.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7873 -5.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1712 -4.4262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3621 -2.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1691 -2.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7461 -2.3599 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.9391 -3.2691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9370 -0.8721 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6230 -2.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7668 -2.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1791 -2.5155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4476 -3.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3039 -4.9617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8915 -4.4564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1724 -0.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2559 1.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1724 0.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -1.2377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9613 -2.4797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7442 -4.8844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9442 -0.6885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4743 -0.8848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4871 -4.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6345 -6.1950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1256 -5.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3219 -0.8389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6594 -1.4198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0941 -1.7391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5775 -4.3955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5187 -6.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0235 -5.2327 0.0000 H 0 0 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 9 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END