PUBCHEM-ZINC03020385 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.2920 1.7580 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.2450 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -0.3550 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -1.8670 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -2.4420 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -3.7680 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -4.4880 -0.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -4.3470 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -3.5230 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 -4.0700 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -5.4330 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -6.2550 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -5.7200 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 -7.7110 -0.2930 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.7290 -8.3360 0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -8.2840 -1.2650 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.5820 -6.1230 0.3180 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 -7.2060 1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4680 -5.0310 0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0040 -6.8300 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1820 -8.1960 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5130 -8.7510 -2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6660 -7.9400 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4890 -6.5740 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1630 -6.0180 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9480 -4.3010 -2.2040 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 2.1850 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 2.2030 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.9630 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 0.0400 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.2000 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -0.1490 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 0.0900 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -2.0730 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -2.3120 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.8670 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 -2.4600 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 -3.4340 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -6.3620 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0620 -8.8300 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6510 -9.8180 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9240 -8.3740 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6080 -5.9410 -4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END