PUBCHEM-ZINC04062642 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.2790 1.8230 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 0.3020 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -0.2980 0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -1.6550 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -2.3920 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -3.7720 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -4.4200 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -3.6920 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 -2.3070 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -1.5670 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -2.0780 0.7700 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 -1.0560 0.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -3.4270 0.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -2.1160 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 -0.9960 3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -1.0250 4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -2.1760 5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -3.2970 4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -3.2680 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2690 -2.2080 6.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -4.5580 0.6580 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9260 -3.9890 0.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -5.7730 0.7160 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7070 2.2810 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 2.0890 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 2.1830 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -0.0580 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 0.0360 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -1.8900 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -5.4980 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -4.2010 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9000 -0.7550 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -0.0970 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -0.1500 5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -4.1950 4.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -4.1450 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -2.5400 7.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -2.8980 6.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -1.2090 7.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END