MMs00168956 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 1.3034 -0.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3121 -2.2424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0174 -2.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2859 -2.2575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6155 -2.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6242 -4.4848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9101 -2.2273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2135 -2.9698 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5082 -2.2122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4994 -0.7122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4567 -0.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7854 1.5453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0975 -0.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5213 -0.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4101 -1.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5354 -2.6523 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1062 -2.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8115 -2.9547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9009 -1.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5030 0.1056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6143 1.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1235 1.1485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0427 0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -0.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7072 0.3876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4863 -0.9439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7941 -3.9147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7486 -3.9237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -1.7362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3286 -1.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8799 -3.3002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1334 -1.3126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6761 -1.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8241 -2.4658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0669 -1.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5018 -0.5597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3316 0.9736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6898 1.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2769 2.4655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9574 1.4320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2002 2.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 20 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 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 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END