PUBCHEM-ZINC03870142 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.5300 1.8680 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 0.5880 0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.2100 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 0.3370 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 1.6670 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 2.4980 -0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 1.9530 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 0.8020 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -0.1920 0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 3.2540 -0.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9690 4.0020 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 3.5610 -1.6910 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3360 2.7060 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 4.6960 -1.5670 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3810 5.6400 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 4.3290 -0.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7540 5.2080 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 3.3480 0.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1150 3.7850 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7030 3.3640 0.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 4.3950 1.5680 P 0 0 3 0 0 0 0 0 0 0 0 0 10.7920 4.9220 0.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8440 3.5380 2.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5190 4.5430 3.9850 S 0 0 0 0 0 0 0 0 0 0 0 0 10.2370 3.9040 5.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9300 4.5610 3.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 4.8170 -2.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 5.8170 -3.9050 P 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 7.1920 -3.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 3.9670 -2.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 4.5750 -3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -1.5090 0.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 2.4660 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 0.7520 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0770 2.8970 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 4.5290 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -1.8320 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -2.0970 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 5.5050 2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8130 5.8220 3.7990 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8490 5.5540 -5.1530 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5730 5.3320 -3.9960 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9150 5.9730 2.8120 H 0 0 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 33 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 40 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 30 31 1 0 0 0 0 32 37 1 0 0 0 0 32 38 1 0 0 0 0 39 43 1 0 0 0 0 M CHG 1 40 -1 M CHG 1 41 -1 M CHG 1 42 -1 M END