PUBCHEM-ZINC05631629 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 1 0 0 0 0 0999 V2000 -1.6080 1.3790 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 1.3400 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 2.2500 -1.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 0.4990 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 0.5210 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 1.3010 -3.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -0.3880 -4.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -0.5340 -5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -1.6450 -5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -2.2570 -5.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -1.8800 -7.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -2.8970 -7.8890 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6100 -3.7910 -7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9960 -2.3910 -8.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 -2.2620 -6.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3230 -1.9900 -7.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7080 -1.5520 -8.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2000 -2.2480 -6.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1880 -2.0970 -6.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8990 -2.5820 -5.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -3.2680 -9.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -2.4290 -9.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 0.6470 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 1.1620 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 2.3710 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -0.2040 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 2.1380 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.0070 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 0.4120 -5.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -0.7860 -5.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -1.3720 -7.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -1.4210 -8.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -3.0770 -8.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8270 -3.1840 -6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -1.4320 -6.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 -4.3410 -9.7930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 26 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 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 M CHG 1 36 -1 M END