PUBCHEM-ZINC05774100 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 3.0330 1.8920 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 0.5850 -2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -0.4890 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -0.2810 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 1.0500 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 2.1260 -1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -1.3970 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 -1.2080 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 -0.6290 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 -0.4820 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0330 -0.9110 2.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 -1.4880 2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 -1.6350 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -2.6120 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -2.7090 -0.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -3.7200 0.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -5.1040 0.2870 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8440 -5.0940 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -5.8640 -0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -5.2560 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -5.5170 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -4.7490 -3.9980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -4.7370 -4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -3.9910 -4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -4.2890 -3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -3.6290 -2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1610 -2.6960 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -2.4190 -5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0700 -3.0630 -5.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 -5.9420 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 -5.4900 1.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 2.7270 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 0.3910 -3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -1.4950 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 1.2760 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 3.1440 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 -0.3190 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8290 -0.0450 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9610 -0.8060 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 -1.8350 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -2.0840 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -3.6470 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 -5.9250 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -6.9030 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -6.1750 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -3.8330 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -2.1820 -3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -1.6880 -5.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.8430 -5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -6.9650 1.7790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 41 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 42 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 30 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 M CHG 1 50 -1 M END