MMs01950322 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.7467 -1.3009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2467 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9934 -2.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4934 -2.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2401 -3.9104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7401 -3.9141 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1401 -4.9534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 -2.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9934 -2.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8720 -3.8365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2998 -3.3766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2688 -4.0844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3036 -1.8766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8781 -1.4095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 0.0585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6872 1.0594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1126 0.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4208 -0.8757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4869 -5.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9868 -5.2189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2402 -3.9028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9869 -5.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7402 -3.8990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0066 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5066 -2.5943 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0131 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0407 0.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5974 1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -0.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 -1.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6375 -4.9481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3668 -2.2037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7048 -1.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4983 -4.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4297 0.4322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4407 2.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0064 1.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5611 -1.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0508 -4.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6157 -6.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0246 -5.7988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7336 -6.5122 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 44 -1 M END