CHEMBRIDGE-ZINC00475788 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -3.5190 3.6370 1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 2.3460 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 1.1420 1.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5650 1.2390 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -0.1430 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 1.0900 2.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 0.7100 2.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0060 1.0270 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8090 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 1.3860 3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 2.4290 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 1.3930 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 1.8280 4.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 1.1960 5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 0.3170 4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 0.1380 5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 0.8280 6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 1.7000 7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 1.8930 6.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 2.4330 8.4660 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0090 2.2680 9.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 3.2020 8.6820 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.2150 4.4830 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5530 3.7720 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 3.5750 2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 2.3390 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 2.2910 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -0.9920 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -0.0710 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -0.2800 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -1.2410 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -1.0480 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -1.2210 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 1.8740 4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 0.6360 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.9640 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 3.2410 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 2.8230 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -0.2220 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -0.5420 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 0.6840 7.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 2.5780 6.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 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 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END