PUBCHEM-ZINC04567363 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1780 1.5350 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 0.0910 0.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.5740 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -1.8880 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.7360 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -4.0680 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -4.8800 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -6.2020 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -6.9730 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -8.2510 -0.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -8.8580 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -9.3570 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -9.9510 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 -10.0650 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -9.5800 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 -8.9860 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 -10.6970 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -11.1110 1.1300 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1930 -2.0600 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.6430 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -0.0110 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -0.7270 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -2.0960 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -2.7550 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 1.9760 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 2.0390 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 1.7660 1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 0.0610 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -2.2980 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -4.6680 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -4.3930 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -6.7640 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -6.4020 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -9.2810 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 -10.3300 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7380 -9.6660 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -8.6190 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 1.0590 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -0.2120 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -2.6580 -0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -3.8260 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 -10.7630 -1.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 42 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 M CHG 1 18 -1 M END