PUBCHEM-ZINC05041202 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4180 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.0110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.6260 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.1300 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4970 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.8770 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.6370 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -2.0150 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.7610 0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.1810 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -2.5550 4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -2.8010 5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -3.4600 6.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -3.7770 7.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -3.2960 7.8240 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -4.4720 8.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -4.9260 9.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -4.4870 11.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -4.9660 11.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -4.3640 9.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -4.8020 8.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -4.7300 12.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -5.1140 12.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 -4.8720 13.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -4.2530 14.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -3.8990 14.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 1.7930 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.7800 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 1.7720 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 1.2080 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 0.0930 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.7150 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.4800 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.4930 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -4.6540 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.5080 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -1.9180 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.8490 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -3.4380 5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2010 -3.6690 6.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -4.4780 9.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -6.0120 9.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -3.3990 11.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -4.9090 11.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -3.2770 10.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -4.6960 9.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -5.8770 8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -4.2720 7.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 -5.5940 11.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 -5.1590 13.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 -4.0510 15.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -3.4170 15.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -4.1370 13.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 53 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M END