PUBCHEM-ZINC05616306 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.4850 1.9670 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 0.5970 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -0.2350 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 0.3150 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 1.6860 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 2.5110 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 2.3840 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 3.6670 0.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 1.3750 0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 2.6420 -1.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 3.6140 -2.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2090 4.3570 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 2.8930 -2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 1.9910 -3.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 4.3080 -3.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5480 3.5600 -4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 5.0770 -2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 4.5420 -3.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7570 5.2470 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 6.4870 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 7.0220 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 6.3190 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7420 7.2410 -1.4460 N 0 3 0 0 0 0 0 0 0 0 0 0 9.8610 6.7700 -1.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 8.3340 -0.9330 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3040 5.2080 -4.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -1.6210 0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 2.6140 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 0.1730 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -0.3290 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 3.5820 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 2.1490 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 2.3350 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 3.6240 -3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 1.4980 -4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 3.5730 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7490 4.8280 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 7.9910 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 6.7390 -2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 5.8470 -3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -2.0030 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -2.2000 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END