MMs01292835 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.2965 -0.7544 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2573 -1.3544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8946 -0.7631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8895 -2.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -3.0087 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5488 -3.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2915 -2.2543 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -4.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0174 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9418 -1.3190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4505 1.2841 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4977 0.7282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5027 2.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8042 2.9738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1008 2.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0957 0.7195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4023 2.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4073 4.4651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6988 2.2108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0004 2.9564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0054 4.4564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3070 5.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6035 4.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5984 2.9477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2969 2.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2919 0.7021 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.3120 6.7020 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6035 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0372 0.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6035 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8298 0.9131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3725 0.9079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 -2.0587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2962 -3.3921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.5047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5789 -5.7087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -4.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4655 2.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8083 4.1738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1329 0.1160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7902 -1.2261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6948 1.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9682 5.0599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6447 5.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6356 2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 M END