MMs03713358 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 42 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 1.5000 -0.0080 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9000 -1.0473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -1.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -1.3191 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0241 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0999 1.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7569 1.2789 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2569 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5139 2.5900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2709 3.8850 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0322 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3999 -1.0714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7429 -1.3352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2429 -1.3433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7569 1.2628 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1625 2.3052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2568 1.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0138 2.5498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5138 2.5417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9138 3.5810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3889 1.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8180 1.7794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8260 3.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4020 3.7505 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0064 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0064 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1132 -1.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -2.4940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8884 2.9662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2285 3.7304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3465 0.7291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8711 0.2246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0612 0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0121 1.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0188 3.1475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0818 4.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0139 2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -2.6302 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 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 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 11 -1 M CHG 1 41 -1 M END