MMs03219695 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 30 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 1.3033 -0.7426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3118 -2.2426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -2.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6151 -2.9851 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5759 -3.5851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9099 -2.2278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2132 -2.9703 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5079 -2.2129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4994 -0.7130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0974 -0.6982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1059 -2.1981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8112 -2.9555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8197 -4.4555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4092 -2.9407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6237 -4.4851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3289 -5.2425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5941 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0426 0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5941 -1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1333 -1.3129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6760 -1.3041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4567 -0.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7873 1.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1332 -0.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8624 -5.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4450 -2.3348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -5.2277 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 M CHG 1 30 -1 M END