CHEMBRIDGE-ZINC02238240 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -2.6160 -0.4690 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.5840 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -0.3670 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -0.5700 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -0.9260 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -1.0750 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -0.9150 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -0.9790 -2.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -1.6010 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -2.9410 -3.9250 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.9450 -5.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -1.3200 -6.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -2.4440 -6.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -0.2630 -7.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 1.0820 -7.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 2.0590 -8.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 1.7090 -9.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 0.3570 -9.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -0.6360 -8.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -0.0530 -10.6130 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1310 0.2960 -10.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -0.7540 -11.4200 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2990 2.5830 -10.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 3.9650 -10.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 0.1020 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 0.9940 1.9140 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8810 0.5550 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -1.1550 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -0.7650 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -0.4290 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -1.0550 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -1.2720 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -0.5220 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.0570 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 1.3970 -6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 3.0850 -7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -1.6810 -8.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 4.1580 -9.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 4.5150 -10.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 4.3320 -9.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.4160 3.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 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 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 2 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 26 -1 M END