ASINEX-ZINC00887978 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.7990 1.6480 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 0.1910 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.5710 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -1.9050 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -2.4880 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -1.7130 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.3780 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.6030 -2.6760 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.2780 -2.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -0.2420 -3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 1.7710 -2.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 1.4110 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 2.0020 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 1.6490 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 0.6940 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 0.1020 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 0.4640 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 0.3120 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2420 0.8260 -0.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -3.9160 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -4.3300 -0.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -4.8430 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -6.0370 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -6.8970 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -6.5790 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -5.3960 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -4.5310 1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -7.7650 4.0980 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.7460 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 2.1820 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 2.0700 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -0.1200 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.4990 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -2.1570 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 2.7080 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 2.7390 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 2.1070 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -0.6360 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 0.0100 -3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -6.2860 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -7.8210 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 -5.1540 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -3.6110 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 -0.6090 -2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1660 -0.8270 -1.8960 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 44 45 1 0 0 0 0 M END