PUBCHEM-ZINC03028628 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.5770 1.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -1.8640 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -2.4610 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.6380 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -2.1980 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -3.5820 4.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -4.4040 3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -3.8500 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -5.8760 3.7080 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7980 -6.5950 2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -6.3660 4.6640 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5760 -4.2960 5.9360 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1110 -2.8450 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 -3.2950 8.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -3.4850 8.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 -3.8980 9.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -4.1220 10.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -3.9330 10.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -3.5140 9.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 -4.6420 11.8080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -2.5010 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -0.5640 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 -1.5630 5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -4.4880 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 -2.2330 6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -2.2590 7.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 -3.3100 7.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9610 -4.0460 9.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -4.1080 11.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -3.3620 9.3290 H 0 0 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 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END