MMs02097676 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2943 -0.7582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6075 1.4835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 2.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2056 1.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8923 -0.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5093 2.2087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8036 1.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0495 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1074 2.1923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4016 1.4340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7054 2.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8716 3.6665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3408 3.9691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0826 2.6653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0718 1.5570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3744 0.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7980 -0.3848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1005 -1.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9795 -2.8505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5558 -2.3780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2533 -0.9088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2820 -4.3197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5846 -5.7889 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.8128 -4.6223 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 15.7512 -4.0172 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 15.9190 0.6118 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6066 1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0354 0.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6066 -1.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5721 2.0901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9189 3.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2315 -0.6396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8847 -1.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 3.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1150 3.3922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9850 4.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8358 5.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2752 2.5323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2394 -2.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6590 -3.1752 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 M END