MMs01089699 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4941 -1.5059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5059 1.4941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2098 2.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2156 3.7492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5176 4.4941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8137 3.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8078 2.2390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1156 4.4839 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4117 3.7289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7137 4.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7196 5.9738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0098 3.7187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3118 4.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3176 5.9636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6196 6.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9157 5.9534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9098 4.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6079 3.7085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2059 3.6984 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.6255 8.2085 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5235 5.9941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5293 7.4941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0805 4.5043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0746 6.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3707 6.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6727 6.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6785 4.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3824 3.7593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0047 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0023 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9976 -0.6117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 -0.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0047 1.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8941 -1.5035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4894 -2.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0941 -1.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8318 1.6533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6368 2.8126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1795 2.8066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0051 2.5187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2808 6.5677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9573 6.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6032 2.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 6.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 7.9593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7095 6.6185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7201 3.9185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3871 2.5594 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 4 1 0 0 0 0 2 5 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 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 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 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 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 24 25 3 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M END