PUBCHEM-ZINC06499593 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 0 0 0 0 0999 V2000 -2.6990 2.5270 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 1.2470 1.6210 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0410 1.4740 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 0.6160 2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4930 -0.0400 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -0.3140 3.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0950 -1.3360 3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 0.0700 1.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9740 -0.7440 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 0.2070 -0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5340 0.8440 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 0.6140 -1.4770 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9480 0.5160 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 2.0300 -1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -0.2880 -1.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -1.1600 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -1.2740 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -1.8580 -1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 0.1330 4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 0.7720 4.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 1.7970 4.1750 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 2.4760 3.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5050 2.6500 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 3.8070 3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 3.8030 3.8090 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1830 3.7340 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 1.6110 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 5.0450 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 4.9540 2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 6.2860 3.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 7.4950 3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 6.4960 5.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 3.3660 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 2.8220 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 2.4290 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 2.1860 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 2.2250 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 2.7690 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 4.6410 3.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 3.8950 4.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 1.2020 4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 0.7850 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 8.1730 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 7.9740 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8670 7.2910 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 5.5850 5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 7.2320 5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 6.8820 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -0.3760 2.2730 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9670 -1.2650 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 0.2620 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -1.7460 0.8630 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8440 -0.2500 5.8340 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0720 2.5680 3.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 2.2280 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 6 49 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 52 1 0 0 0 0 19 20 2 0 0 0 0 19 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 54 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 43 1 0 0 0 0 31 44 1 0 0 0 0 31 45 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 49 1 M CHG 1 52 -1 M CHG 1 53 -1 M END