PUBCHEM-ZINC06904676 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -0.4920 -1.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2700 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 0.0340 -1.1920 N 0 5 0 0 0 0 0 0 0 0 0 0 2.1480 1.5020 -1.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1770 1.8600 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 1.9610 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 2.4400 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 2.4900 -3.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 2.9120 -4.7280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5800 3.4540 -4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 1.7050 -5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 3.0590 -7.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 4.2660 -6.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 3.8000 -5.4850 N 0 5 0 0 0 0 0 0 0 0 0 0 0.8090 -1.9570 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -2.6360 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -2.0350 -3.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -4.1430 -2.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1460 -4.5200 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -4.6150 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -6.5920 -3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -6.1200 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.6520 -3.5250 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8890 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.8790 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.3660 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 3.1380 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 1.7190 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 1.1470 -5.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 1.0600 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 3.4000 -8.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 2.5170 -7.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 4.9110 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 4.8240 -6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -4.2150 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -4.2620 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -7.6820 -3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -6.2150 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -6.4730 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -6.5200 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 2.1710 -6.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 1.3930 -7.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -6.0830 -2.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -6.4230 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -2.4370 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 1.9200 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 18 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 45 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 5 -1 M CHG 1 17 -1 M CHG 1 26 -1 M END