PUBCHEM-ZINC06678248 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 1.4320 -1.6390 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -2.8350 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.4660 2.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7330 -1.6680 2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -3.6910 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -2.0510 2.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -0.9650 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -0.5490 4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 0.5750 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 1.2820 4.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 0.8500 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -0.2670 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 1.5740 3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 1.7590 1.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6590 1.9480 4.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8960 2.6280 4.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7470 3.0680 2.7660 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2630 2.9240 5.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 3.0820 6.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6130 3.7080 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8380 3.8660 7.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0170 3.3860 7.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9760 2.7440 6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7270 2.5890 5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1980 2.1830 5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2010 2.9500 5.3250 O 0 5 0 0 0 0 0 0 0 0 0 0 13.4670 3.5610 8.2790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -1.2440 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -1.9330 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.8330 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -3.2440 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -3.6090 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -4.0590 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -4.5000 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -3.4590 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -1.0840 4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 0.9020 5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 2.1740 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -0.5960 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3470 1.6650 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4990 3.0800 6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 4.0920 7.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8620 4.3570 8.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7150 2.0300 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1060 0.9880 5.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 2 0 0 0 0 M CHG 1 26 -1 M END