PUBCHEM-ZINC05790959 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.0670 1.4840 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.0460 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.5340 -0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -1.8660 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -2.5980 -0.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -2.4460 -0.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2720 -3.9610 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -1.9730 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -0.4790 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 0.0320 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -3.9510 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -4.6770 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -6.0630 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -6.4090 2.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3650 -6.0650 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -7.9020 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -8.6720 3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -10.0410 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -10.6400 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -9.8700 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -8.5020 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -12.1060 2.2980 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8580 -12.7850 3.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -12.6340 1.5430 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7560 -5.7680 1.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.8510 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 1.8420 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.8490 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.4110 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.4040 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -2.4620 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -2.2260 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 0.1690 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1160 1.1020 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -0.6160 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -5.4110 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -5.1850 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -6.4070 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -6.5520 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -8.2040 3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -10.6430 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -10.3380 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -7.9000 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -6.0270 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -4.6120 1.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -2.1160 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 46 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 31 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 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 45 2 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END