CHEMDIV-ZINC02944778 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.6090 3.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -0.0290 5.1830 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -0.7110 6.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 1.3860 5.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -0.5480 5.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -1.7580 6.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 -2.1790 6.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -1.3890 6.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -0.1620 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 0.2560 5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 0.4400 5.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 1.5020 4.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -0.5480 5.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -0.4370 5.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -1.5800 6.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.9610 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.5720 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -1.2700 3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -2.3800 6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -3.1260 6.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 1.2010 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 -2.3600 6.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 36 1 0 0 0 0 M END