MMs00947747 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 0.4755 -1.4226 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6836 -1.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -2.6435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -3.8496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1963 -5.3194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3194 -6.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -5.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0416 -4.3684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9185 -3.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9059 -1.8742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -0.9824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4874 -1.5809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9427 0.5081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4642 -3.8930 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9888 -2.4703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9397 -5.3156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8869 -3.4175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0100 -4.4118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4326 -3.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7322 -2.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1548 -1.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2779 -2.9854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9784 -4.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5557 -4.9306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7006 -2.5099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8237 -3.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0198 -7.7835 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1381 0.3804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3804 1.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1381 -0.3804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2945 -1.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -3.4539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9418 -5.6998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6405 -6.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 0.6435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8072 1.7004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7504 0.3726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1265 -2.2417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0706 -5.1585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5822 -5.4666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8337 -1.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3945 -0.8152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8768 -5.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3161 -6.1065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0282 -4.4027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7221 -4.2996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6191 -2.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 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 42 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 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END