PUBCHEM-ZINC04680437 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 0.2060 1.1790 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.3380 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -0.6720 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -2.1890 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -2.5080 -2.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -4.0550 -2.5830 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -4.0450 -3.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -4.4730 -1.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -5.0700 -2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -5.2620 -3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -6.0560 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -6.6630 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -6.4690 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.6770 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -7.4680 -2.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -8.2010 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -8.2380 -4.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -8.9600 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -8.9200 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 -9.6300 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -10.3820 -3.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0300 -10.4260 -4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -9.7150 -4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3860 -11.2470 -6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1840 -11.1560 -3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.5640 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 1.6390 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.4170 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -0.7980 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -0.7220 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -0.2120 -1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -0.2870 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -2.6490 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -2.5740 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -1.8140 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -4.7890 -4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -6.2050 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -6.9400 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -5.5290 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -7.4990 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -8.3340 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2480 -9.6000 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -9.7470 -5.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 -10.6320 -6.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -11.6050 -6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 -12.0980 -5.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9700 -10.5290 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0570 -12.0440 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4590 -11.4540 -2.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END