COMGENEX-ZINC06775513 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 -0.3140 0.7400 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.5590 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -1.0700 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -0.2320 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 1.0640 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 1.5530 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 2.0690 1.5420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.4910 -0.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4760 -2.9600 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -2.4760 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -3.8690 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -4.3680 -2.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -3.2330 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -3.6380 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -4.3020 2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -4.7100 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -4.3410 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -3.6880 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -3.5980 2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -4.1590 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -4.8070 4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -4.9090 4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -4.0570 4.3690 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3300 -3.3670 3.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -4.6630 5.4190 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3320 1.1170 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -1.1750 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -0.5960 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 2.5620 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -1.8060 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -2.1040 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -3.5300 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -3.1000 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -5.2430 5.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 -5.4150 4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -4.3380 -2.4100 O 0 5 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 36 -1 M END