PUBCHEM-ZINC06072012 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 1.7720 -3.4080 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -2.5890 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -3.0990 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -2.3420 1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.0950 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -0.4400 1.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -0.5620 -0.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 0.3390 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.2740 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.7900 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -2.8960 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -3.2740 2.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -4.5100 2.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9960 -4.6370 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -4.5010 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -3.4710 0.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -3.7570 -0.3210 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1560 -4.0440 -1.3250 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.3190 -5.6660 3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -5.5640 4.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -3.9780 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -2.7450 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -4.0920 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -4.1000 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -3.7710 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.1440 3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -5.4760 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -4.2860 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -6.6140 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -5.6200 3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -6.2660 4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 M CHG 1 17 1 M CHG 1 18 -1 M END