PUBCHEM-ZINC01530737 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 0 0 0 0 0 0999 V2000 -1.0770 -2.2100 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -1.5460 -0.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -0.2350 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 0.1450 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 1.4050 1.8560 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1830 1.5740 2.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 2.2130 2.0140 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8130 0.5210 -0.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 1.9550 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 2.4120 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 4.2230 -0.9330 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 4.4620 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 5.9050 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1650 6.5540 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 8.2110 -0.9830 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 7.9530 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 6.7160 0.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 9.0870 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 8.7980 2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 9.5620 3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -3.2140 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -2.3150 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -1.6600 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.1130 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.4320 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -0.0470 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 2.5120 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 2.1720 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 1.9320 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 2.1370 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 3.8580 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 4.1220 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 6.1440 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 10.0070 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4790 9.2750 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 9.8280 1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 8.1310 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 8.4520 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7280 9.3910 4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 10.6160 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 9.2190 4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 8.7540 2.6130 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6980 7.7620 2.8350 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 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 42 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 42 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 5 1 M CHG 1 7 -1 M CHG 1 42 1 M END