MMs03367690 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.5000 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5068 2.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2601 3.8912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7534 1.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0117 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1000 1.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7466 -1.3166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2466 -1.3205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9932 -2.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 -4.0469 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7372 -4.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9530 -4.0532 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4932 -2.6254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2466 -1.3283 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4466 -1.3314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2533 1.2698 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0982 -4.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7466 -1.3088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3439 -2.3496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0031 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2885 -1.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6266 -0.4173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5895 3.3679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5855 1.8252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2978 3.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8628 4.9289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2225 4.4939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8821 1.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5481 2.4716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7947 1.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1287 0.3919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7341 -6.1317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7303 -3.3644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -4.8745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4660 -5.6489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2534 1.2932 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0534 1.2932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 42 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 15 16 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 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 12 1 M CHG 1 42 1 M END