PUBCHEM-ZINC02189053 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3150 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.7770 -0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1370 -0.1040 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.8540 1.0740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0560 -2.5450 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -2.5880 0.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -2.0180 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -2.6690 0.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -0.7500 0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -1.2020 2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.6210 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -0.0230 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.0050 4.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -0.5890 4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -1.1910 3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -0.5710 5.1480 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7790 -1.0830 4.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -0.0440 6.2460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5000 -1.4240 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -2.6250 -1.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -0.6650 -2.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7530 -1.3560 -3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -0.3340 -4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 0.4950 -4.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 1.4620 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 2.3020 -5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 3.2850 -6.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 3.4310 -7.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 2.5950 -7.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 1.6070 -6.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8680 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8420 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -3.5220 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.3590 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -0.6350 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 0.4310 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -1.6490 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -1.9140 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -2.0440 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -0.8560 -5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 0.2840 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 2.1890 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 3.9400 -6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 4.2000 -8.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 2.7120 -8.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 0.9510 -6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 0.5830 6.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.0150 6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 35 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 48 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END