PUBCHEM-ZINC05131852 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.3120 1.4030 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -0.1350 -0.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2790 -0.4920 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.7830 -0.0740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1560 -0.4030 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -2.3190 0.1150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6240 -2.7470 1.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1150 -2.5590 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -2.0030 1.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1700 -2.0870 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -2.4870 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -1.5740 0.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 -1.9090 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -4.1580 1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -4.3670 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -2.9080 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -2.3070 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -0.6060 -1.2420 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0230 1.8680 0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 2.8300 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 1.7790 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8130 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -2.7660 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -3.4840 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -2.5090 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -0.5340 1.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4390 -0.1000 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.0890 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 19 20 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 26 1 M END