PUBCHEM-ZINC03636533 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 3.0170 1.1930 -4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 0.4480 -4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.6460 -1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 0.1360 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -1.5220 -2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -2.6900 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -3.9730 -3.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -4.1420 -4.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -5.1070 -3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -5.2650 -4.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -4.4540 -5.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -3.4850 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -3.3290 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -5.0190 -2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -6.1920 -2.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -4.7020 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -5.1280 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -4.8270 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -4.1170 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -3.7170 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -4.0190 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 -3.7870 1.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5060 -4.1730 0.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -3.1270 2.0900 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1120 1.9640 -3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 0.5070 -4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 1.6870 -5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 1.1160 -4.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -0.2930 -4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 0.7190 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 1.6340 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.8260 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 0.0220 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 0.8490 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -1.2170 -3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -1.8110 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -2.4920 -4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -2.7830 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -5.7490 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -6.0240 -4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -4.5790 -6.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -2.8520 -6.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.5730 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 -5.6880 -2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -5.1550 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -3.1860 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -3.7370 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -0.2870 -2.7760 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5520 -0.6060 -2.5370 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 28 1 0 0 0 0 2 29 1 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 48 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 14 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 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 48 1 M END