PUBCHEM-ZINC03167971 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -0.9950 -1.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -1.8760 -1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 -2.1960 -2.9500 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5340 -1.2690 -3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6770 -2.9280 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8060 -4.0430 -3.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 -2.3440 -2.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9200 -3.0240 -2.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9090 -2.4610 -1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1890 -3.1770 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2540 -2.5720 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4490 -3.2450 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5950 -4.5220 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5380 -5.1260 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3380 -4.4640 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7740 -5.1820 -0.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 -3.0380 -3.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -2.4720 -4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -1.2630 -4.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -3.3220 -5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -2.7390 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.5370 -6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -4.9130 -6.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -5.4970 -5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -4.7100 -5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -5.7640 -7.2540 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2000 -5.2520 -7.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -6.9750 -7.2410 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -1.2490 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -2.8030 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 -1.4520 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7940 -1.4680 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1420 -1.5800 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2730 -2.7790 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6560 -6.1190 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5150 -4.9360 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8320 -5.7190 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 -4.0030 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -1.6650 -5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -3.0870 -7.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -6.5720 -5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -5.1670 -4.5640 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 46 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 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 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 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 M CHG 1 33 1 M CHG 1 35 -1 M END