PUBCHEM-ZINC05829235 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 43 0 0 1 0 0 0 0 0999 V2000 0.2880 2.2470 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 0.7930 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 0.6630 -2.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9320 1.2770 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -0.8210 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -2.3970 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 -2.4960 -4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -3.9110 -4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.3610 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 4.1710 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 5.5130 1.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 3.3590 2.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 3.7730 3.5270 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7350 4.9800 3.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 2.8420 4.1820 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7960 2.7450 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 2.7960 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 0.2670 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 0.2970 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -1.4200 -2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -1.2430 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 -2.6160 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -3.0640 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -1.7800 -4.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -2.2240 -5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -4.6440 -4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -4.2020 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.8970 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 1.8460 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 5.9230 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 6.1250 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 2.3660 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.9910 -3.4520 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4280 -0.3490 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -0.7720 -4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 -3.9900 -5.1870 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9850 -3.3820 -4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5940 -4.9490 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -3.7600 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 1.2250 -3.6130 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4170 0.7400 -3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 2.2060 -3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 1.2680 -4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 3.7800 0.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 40 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 36 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 44 2 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M CHG 1 33 1 M CHG 1 36 1 M CHG 1 40 1 M END