PUBCHEM-ZINC03091357 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 0.0180 1.4360 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 0.0480 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -0.5810 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.2420 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 1.5950 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 2.1560 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -2.0820 -0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5670 -2.5480 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -2.5620 -1.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4570 -2.1310 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -4.1130 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -4.7310 -2.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.4980 0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 1.9400 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -0.5400 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -0.1820 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 3.2400 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -3.4660 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -4.5430 -0.4810 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3790 -2.2720 -2.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -2.6290 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -2.9380 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 14 1 0 0 0 0 2 3 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 13 18 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 19 -1 M END