PUBCHEM-ZINC04458970 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 -0.4630 1.8240 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 0.3280 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.4290 0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1930 -0.1860 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -1.9120 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -2.5140 1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -2.5680 -1.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -4.0100 -1.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1770 -4.2660 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -4.3890 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -5.3160 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -5.6640 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -5.0860 -4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -4.1600 -4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -3.8150 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -4.7580 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -4.1500 -0.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -6.1000 -0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -6.7540 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 0.0510 1.6950 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -0.6860 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -0.5750 2.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7800 -1.1190 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -1.8110 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -1.9070 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.3330 0.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6280 -2.5870 -0.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -0.9980 3.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 2.3720 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 1.9960 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 2.1680 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -0.0340 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.1650 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -2.0870 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -5.7670 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -6.3870 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -5.3570 -5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -3.7080 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -3.0950 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -6.4500 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -6.4680 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -7.8350 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -2.2630 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5030 -3.0000 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -2.6500 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -0.5150 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -1.3970 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 20 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 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 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 39 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 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END