CHEMBRIDGE-ZINC03001601 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 0.0690 1.2640 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -0.1950 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -0.6540 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -0.8990 0.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -2.2200 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -2.8240 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -4.1940 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -5.0910 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -6.3910 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -6.7910 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -5.9140 -2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -4.6110 -1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -8.0380 -1.6260 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.9540 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -3.8970 0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -2.4520 -1.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -2.9570 -2.3720 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7080 -3.3410 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -4.0370 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -5.4210 -2.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -6.5000 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -7.6830 -3.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -1.8070 -3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -0.8310 -3.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.8370 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 1.6530 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 1.3830 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -0.4080 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -2.2870 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 -4.7850 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -7.0920 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -6.2470 -3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -3.9360 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -1.6250 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -3.7380 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -4.1190 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -5.7580 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -5.3770 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -6.1040 -4.6500 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7810 -1.9680 -3.5850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 39 -1 M CHG 1 40 -1 M END