MMs01497314 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.3017 -0.7454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -2.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0091 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8435 1.3055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3526 -1.2872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8944 0.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8892 2.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1856 3.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4872 2.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 0.7729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 -1.4725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0906 0.7820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6886 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2867 0.8003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2814 2.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9797 3.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6833 2.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7836 3.0274 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5963 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 0.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5963 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -2.2496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3112 -3.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5069 -2.2412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8478 2.8600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1813 4.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2003 -1.1817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0863 1.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6241 -0.8854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1668 -0.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9945 -1.1543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3280 0.2040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3185 2.9040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9755 4.2457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6420 2.8875 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 3 1 0 0 0 0 2 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END