NCID-ZINC05837722 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.2740 1.2320 3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.1120 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -1.2580 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -2.4490 2.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -2.6630 1.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7670 -2.6670 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -4.0890 1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1220 -4.8790 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -3.7030 2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -4.2520 4.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -4.3710 0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -3.6230 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -5.6000 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -6.5220 0.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -5.7000 0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6310 -4.8940 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -5.4700 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 -6.4480 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -6.2280 -3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -5.0260 -4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -4.0400 -3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 -4.2570 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 -7.0390 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5470 -8.4440 0.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 -9.3040 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 -10.9750 1.4350 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 -8.5400 2.7660 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -7.2440 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 -8.8930 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7030 -8.8950 -2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 -8.0840 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -1.4540 0.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.0290 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -1.2220 4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -0.6220 5.4210 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7030 1.1730 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 1.8630 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 1.7360 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -7.3910 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -6.9960 -4.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -4.8580 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -3.0970 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -3.4700 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 -6.4980 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 -6.5940 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -7.5380 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -6.3370 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7400 -9.9250 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -9.3750 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 -9.4430 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4820 -7.8820 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2360 -8.0910 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4130 -8.5130 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -7.0400 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 0.0760 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 0.8570 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -7.0020 0.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -1.7490 5.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 57 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 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 58 2 0 0 0 0 M CHG 1 35 -1 M END