MMs03252557 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.5000 -0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -1.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7413 -1.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7585 1.2742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2585 1.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7413 -1.3436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7584 1.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2584 1.2445 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6584 2.2838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0170 2.5386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5169 2.5287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2412 -1.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7411 -1.3832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4997 -0.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7583 1.2148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2583 1.2247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0079 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0079 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6345 -2.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3345 -2.3669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3653 2.3095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6654 2.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6335 1.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9746 2.4348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8998 -1.1086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1109 -1.7763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4417 -2.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5250 -2.5636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8660 -1.8011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4138 -0.8665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4240 0.6761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8886 1.6178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5577 2.3979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1334 1.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4745 2.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2756 3.8426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3930 -1.0947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8824 4.8778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 42 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 30 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 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 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 41 44 1 0 0 0 0 42 43 1 0 0 0 0 M END