NCID-ZINC01646001 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.4310 1.8230 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 0.3040 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -0.3190 0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -1.9140 0.1160 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -2.4510 1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -2.2960 0.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0910 -2.0000 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -3.7760 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -4.3010 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -5.6580 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -6.4910 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1490 -5.9670 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 -4.6080 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 -6.8590 -1.3150 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6390 -8.0550 -1.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 -6.3960 -2.4290 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9710 -1.5620 1.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 -0.4120 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 0.3280 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 1.4640 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2910 1.8650 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 1.1290 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -0.0050 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 3.4200 0.9140 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -2.5890 -1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.5600 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -3.2890 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 2.2940 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 2.1810 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 2.0770 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 0.0440 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -0.0420 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -3.6500 2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -6.0680 3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -7.5520 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -4.1980 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -1.8740 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 0.0160 3.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 2.0410 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 1.4430 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -0.5760 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -1.5250 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -3.0520 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -3.2670 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -4.3240 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -2.7960 -3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END