PUBCHEM-ZINC02877893 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0090 1.3810 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0000 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.6810 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.0190 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4000 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0860 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 3.4840 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 4.1440 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 3.5270 1.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 5.6170 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 6.3290 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 7.7040 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 8.3790 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 7.6820 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 6.3040 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 5.4280 1.6980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 9.8550 0.1570 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7480 10.4720 -0.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 10.4520 0.6140 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2170 -2.4420 -0.0450 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -2.8390 0.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.8590 0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.9160 -1.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -2.6030 -2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -2.3150 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.9880 -4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -3.1790 -4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -3.4680 -2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -3.7940 -2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 1.9120 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -0.5490 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -0.5160 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 1.9450 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 3.9800 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 5.8040 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 8.2560 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 8.2150 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -3.4010 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -1.7270 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -3.1910 -4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -1.4660 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -1.7830 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -1.1120 -4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -4.0550 -4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 -2.9460 -4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 -4.3160 -2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 -2.5910 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -4.0000 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -4.6710 -2.6560 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 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 37 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END