IBS-ZINC04438109 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.2090 1.0530 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.3230 2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -1.0260 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -0.3590 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.0310 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 1.7340 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 1.7500 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 3.0190 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 3.7340 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 3.0750 0.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8870 3.6700 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 2.9630 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1860 3.6010 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1410 4.9470 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 5.6710 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 5.0400 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 5.7620 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4720 6.9420 -0.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 5.0640 0.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 5.7020 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 5.6990 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 6.3290 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 6.9640 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 6.9700 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 6.3340 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 7.5940 2.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -1.1130 1.6820 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3910 -0.7380 0.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 -2.1090 2.3070 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6840 1.5950 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.8500 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -2.0990 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 2.8080 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 1.2610 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 3.5080 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1340 1.9160 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1070 3.0510 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0260 5.4310 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9490 6.7180 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 5.2040 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 6.3260 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 7.4560 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 6.3330 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 7.0250 3.5060 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END