PUBCHEM-ZINC05499390 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 1.0090 -1.5140 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -1.9330 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -0.9370 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -0.7080 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -0.2730 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 1.2220 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 1.6200 2.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 2.8970 3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 3.9910 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 5.2880 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 5.4840 4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 4.4050 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 3.1270 4.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 2.1050 5.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 0.9440 5.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 2.5530 7.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 1.5950 8.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 1.9490 9.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 3.2700 9.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 4.2440 8.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 3.8980 7.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 4.8340 6.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 6.1890 6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 6.5860 4.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 7.1060 7.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 0.9190 10.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 1.2200 11.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -2.3910 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 -0.8080 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -1.0450 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -2.4150 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -2.6250 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -0.2230 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -1.9520 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 0.3070 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -1.4130 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -0.8350 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -0.4610 2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -0.9140 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 1.8100 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 1.4200 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 0.9320 3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 3.8620 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 6.1150 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 0.5640 7.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 3.5820 10.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 5.2450 8.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 7.1760 8.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 8.1160 6.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 6.7860 7.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 1.9530 12.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4450 1.5620 11.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 0.2980 12.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -0.7110 0.2100 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7180 0.0580 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 54 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END