MMs01308601 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 0.7413 1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0174 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5174 2.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2587 1.2839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7586 1.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 -0.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7586 1.2537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7411 -1.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9824 -2.6383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7237 -3.9423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2237 -3.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9824 -2.6584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2411 -1.3544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4998 -0.0704 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.5098 1.4295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4897 -1.5704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9997 -0.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7410 -1.3845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2410 -1.3946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9997 -0.1006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2584 1.2034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7584 1.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4996 -0.1107 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.2761 3.8819 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9412 1.3121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5756 3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -1.0533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5582 2.4570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 1.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8929 -1.0654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7825 -2.6302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1167 -4.9775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8167 -4.9956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1823 -2.6664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4068 0.9829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1340 -2.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8340 -2.4378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8654 2.2386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1654 2.2567 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 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 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END