MMs01694444 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 0.0115 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3162 2.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6095 1.4801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 -0.7599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2818 -2.2599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -3.0198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8798 -2.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8913 -0.7798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3277 3.7399 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2818 2.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5865 1.5199 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8798 2.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1845 1.5398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1960 0.0398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4778 2.2997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7825 1.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 0.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0987 -0.6803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3805 1.5795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0758 2.3196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0438 -0.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6533 2.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7967 -3.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3393 -3.9449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2815 -3.4105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0631 -2.0805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5034 3.1732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0461 3.1850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1014 3.1931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6441 3.2049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4686 3.4996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7825 2.7597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6107 0.2590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3922 -1.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3345 -1.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8771 -1.5937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8110 -1.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5721 0.2970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5638 1.3802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7823 2.7103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2974 3.2329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8401 3.2447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 M END