PUBCHEM-ZINC05161472 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0750 1.3980 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -0.0850 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -0.6170 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.7230 0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -2.1500 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -2.6170 1.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -2.5800 2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -2.2370 2.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -2.9870 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -3.4890 3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -3.8710 5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -3.7530 6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -3.2510 6.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -2.8630 4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -2.3630 4.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 -2.1560 5.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8470 -1.6170 4.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 -2.0470 4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 -1.0970 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 -0.1520 4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -0.4590 5.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -4.1750 7.9350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.5270 5.4680 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -5.8330 6.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -4.5870 4.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -3.4890 6.3980 N 0 5 0 0 0 0 0 0 0 0 0 0 2.3140 -3.5240 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 1.9050 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 1.7120 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 1.6740 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -2.5640 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -2.5310 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -3.5870 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -3.1650 6.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -2.1200 3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 -3.1080 6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -1.4690 6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 -2.9330 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6000 -1.0980 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9590 0.7530 5.2210 H 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 26 -1 M END