PUBCHEM-ZINC04703667 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -0.7580 -0.7740 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 0.0390 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 1.2120 0.3170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -0.5370 -0.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -1.9820 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -2.5660 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -1.8150 -3.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.4110 -3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 0.2610 -2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -2.4180 -4.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -3.5760 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 -4.1730 -5.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -3.6210 -6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -2.4630 -6.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -1.8570 -5.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -1.9050 -8.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.7220 -8.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.3180 -9.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 0.0040 -10.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 0.9170 -9.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -1.4710 -10.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 -4.2640 -7.6390 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8480 -4.7650 -7.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -4.2930 -8.7480 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6980 -1.3060 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -1.4920 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -0.1110 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -2.1500 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.4580 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -3.6130 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -2.4900 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 0.1050 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -0.3640 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 1.2660 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 0.3120 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -4.0100 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -5.0740 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -0.9550 -5.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -2.3010 -8.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 0.0990 -7.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.9520 -8.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 0.8250 -9.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 0.2920 -11.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -0.8760 -9.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 0.6880 -9.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 1.2050 -11.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 1.7380 -9.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -2.3510 -10.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.1830 -11.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.7000 -10.3850 H 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END