NCID-ZINC05459832 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.0750 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -0.3950 0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.6530 1.8720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9600 -1.5170 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -1.0850 1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -0.9920 -0.3020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7980 -0.0040 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -1.4050 -0.7570 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.5900 -1.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -2.0360 -0.1990 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5720 -1.7200 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -1.7520 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 -2.1270 2.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -3.4300 -0.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -4.0340 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -3.9370 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -3.3060 -2.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -5.3600 -2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -6.4590 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -7.6780 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -8.7220 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 -8.5650 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9120 -7.3670 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -6.3220 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -5.5820 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -5.0090 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -5.1090 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -5.7820 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -6.3600 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -6.2610 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.5350 2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 1.3360 2.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -0.9670 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 1.4990 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.1820 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 1.6940 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -5.3880 -3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -7.8250 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -9.6560 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -9.3750 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -7.2450 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -5.4060 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -4.4570 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -4.6490 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -5.8500 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -6.8790 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -6.7110 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.8560 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -2.0360 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -0.4550 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 0.5780 3.7780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 31 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 M CHG 1 51 -1 M END