MMs00697155 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 36 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 0.6549 -1.3495 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5042 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1864 -2.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6825 -2.4838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -1.4571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1175 -0.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7575 1.1462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5071 -0.8747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7808 -0.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1038 -0.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3774 0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7005 -0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7498 -2.2029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4762 -2.9952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1532 -2.2884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5255 -4.4944 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 11.0728 -2.9097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9741 0.0887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9248 1.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3995 -2.3708 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9433 -2.7308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3787 -4.1204 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0796 0.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5239 1.0796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0796 -0.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7413 1.1170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 1.2025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1342 -2.9222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1123 -4.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1241 1.6273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8853 2.7872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7254 1.5484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4685 -3.9409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2046 -4.9344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 27 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 28 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 34 35 1 0 0 0 0 M END