PUBCHEM-ZINC04573041 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.4850 -1.0730 -3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -2.1130 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -3.3100 -3.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -1.6770 -1.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -2.6730 -0.7020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7790 -3.4770 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -2.0150 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -0.3360 0.4490 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -0.2800 -1.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0320 0.1860 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 0.5210 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 1.8930 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 2.6600 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 2.0720 -3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 0.7160 -3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -0.0540 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -3.3050 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.7440 0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -4.5610 0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -5.2510 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -5.8000 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 -6.5400 0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 -6.9630 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -8.1140 2.7490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -7.8490 3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -7.4740 2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.5630 -4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -0.5860 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -0.3320 -3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -1.9570 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -2.5200 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 2.3790 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 3.7190 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 2.6700 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 0.2580 -4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -1.1090 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -5.0090 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -4.5470 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -6.0610 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -6.6510 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -5.0260 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3970 -5.6230 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -7.3390 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 -7.2260 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -6.1490 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -8.7580 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -7.0570 4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -8.2810 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -7.2150 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -6.2590 1.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9760 -5.4730 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 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 17 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 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 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 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 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 50 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 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END