MMs01449871 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 0.7404 -1.3045 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3404 -2.3438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2403 -1.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2403 -1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7402 -1.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7594 1.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2594 1.2602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0192 -2.5980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5191 -2.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2595 -1.2824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2787 -3.8804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7787 -3.8693 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5382 -5.1628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7978 -6.4673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0382 -5.1517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7786 -3.8472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2785 -3.8361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0381 -5.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2977 -6.4341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7978 -6.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0574 -7.7497 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.5381 -5.1185 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0436 0.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5923 1.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0436 -0.5923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0233 -2.4958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3649 -1.7343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8753 0.3966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 1.1581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6326 -2.3725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3325 -2.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6998 -0.0642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 2.2840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6671 2.3039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5731 -3.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1541 -4.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4958 -5.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1709 -2.8124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8709 -2.7925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9054 -7.4689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 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 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 M END