CHEMBRIDGE-ZINC01141259 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.1710 0.5650 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 1.2480 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 0.7370 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -0.4730 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -1.1570 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.6340 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -1.0260 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -2.2180 -0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -0.1340 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 -0.6490 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 0.1880 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 1.5430 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 2.0590 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 1.2280 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 2.3640 -0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 2.4580 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4880 1.7280 -2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0980 1.8250 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 2.6480 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6860 3.3770 -3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0760 3.2880 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5960 4.0740 -0.6820 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5600 4.8030 -0.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0610 3.9910 0.4090 O 0 5 0 0 0 0 0 0 0 0 0 0 10.8600 2.7520 -5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1920 1.9300 -6.3900 F 0 0 0 0 0 0 0 0 0 0 0 0 10.8100 4.0780 -5.9200 F 0 0 0 0 0 0 0 0 0 0 0 0 12.1940 2.3450 -5.3720 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 0.9680 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 2.1840 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 1.2720 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -2.0940 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -1.1630 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -1.7010 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 -0.2090 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 3.1120 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9320 1.6290 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 1.0840 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 1.2560 -4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5440 4.0190 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END