PUBCHEM-ZINC06420588 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 1.8330 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 2.2710 -2.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 2.2730 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 1.8650 -2.3930 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1900 1.7380 -2.6980 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8970 2.6700 -4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 3.3080 -5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 3.5730 -6.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 3.1650 -7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 2.3880 -5.9580 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 1.6640 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0320 2.6560 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 2.4920 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 1.3480 1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 0.3620 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 0.5100 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 2.5280 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 3.5850 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 4.0740 -6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 3.2900 -8.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 3.5500 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 3.2580 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 1.2240 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -0.5290 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -0.2620 0.3880 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 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 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 23 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 M CHG 1 6 1 M CHG 1 7 -1 M END