MMs02939934 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 1.5000 0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2418 1.3131 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4837 2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0163 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7418 1.3225 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7324 2.8224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7512 -0.1775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2418 1.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2417 1.3506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4836 2.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9836 2.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7417 1.3600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 0.0657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7579 -1.2380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 0.0751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7579 -1.2192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2578 -1.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0160 -2.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5159 -2.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2578 -1.1911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4997 0.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9997 0.0939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2415 1.4070 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 17.2740 -3.7891 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.0160 -2.5229 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3197 -3.2648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7123 -1.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2742 -3.8266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0075 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -1.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6301 -0.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6088 3.0249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2679 3.7879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0238 3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2162 2.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0125 1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4064 -1.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1063 -0.9885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0771 3.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3771 3.6710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3352 2.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7840 1.2555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1248 0.4926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4225 -3.5471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4578 -1.1836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3932 1.1293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2312 -3.2332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6807 -4.8696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3171 -4.4201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 28 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 49 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END