MMs02777146 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.7571 -1.2949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2571 -1.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2571 -1.2702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5142 -2.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0142 -2.5815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 -1.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5142 -2.5568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7427 1.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2427 1.3609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 0.0660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2570 -1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7570 -1.2454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4998 0.0742 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0143 -2.5980 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 -3.3409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2889 -1.8552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7286 -3.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0286 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7143 -6.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2143 -6.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9714 -5.2126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2285 -3.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0359 0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6057 1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0359 -0.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3943 1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0942 1.0672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1199 -3.6092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -3.6241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8942 1.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1370 2.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8370 2.4034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8627 -2.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2285 -5.1895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1086 -7.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8085 -7.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1714 -5.2192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8342 -2.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END