PUBCHEM-ZINC05116006 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.7300 1.3110 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 0.0170 -1.2060 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5940 0.2390 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -0.7680 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.7160 -1.6480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6500 -0.5970 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -0.1620 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 1.2970 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 2.3300 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 3.4660 -1.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 3.1780 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 1.8270 -2.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.3310 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 4.3430 -3.6470 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 5.8820 -2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 7.0680 -3.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6980 6.9200 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 8.3570 -2.8110 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7000 8.3200 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 9.5370 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 10.2030 -4.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 7.1640 -4.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -2.1780 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.5120 -0.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.9940 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.1700 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 1.7300 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 0.5800 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -0.6930 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 0.9960 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -1.0080 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.6900 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -0.1870 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -0.2750 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -0.7110 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 2.2580 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 5.9860 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 5.8610 -1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 8.5310 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 7.2970 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 9.8490 -4.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 8.4940 -2.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 7.7490 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -3.1100 -2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -4.0350 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 10.6140 -4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 42 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 39 42 1 0 0 0 0 41 46 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 2 1 M END