PUBCHEM-ZINC06092916 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.1140 1.6560 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 0.2810 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -0.6110 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -0.1390 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.2360 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 2.1470 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 3.6350 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 4.3160 1.8160 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 6.0430 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 6.9280 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 8.2670 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 8.7990 0.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 7.8530 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 6.5210 0.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 8.9120 3.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 7.9680 4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 6.7590 3.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 10.3300 3.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3010 10.8390 2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 10.6730 3.7870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8490 9.9860 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 12.0410 4.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1400 12.3280 5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 11.9120 5.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6390 12.8140 5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 10.8300 4.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 11.5470 6.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 11.4680 7.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 10.9660 6.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 13.0400 3.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 12.5690 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 10.8430 2.6910 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6510 -2.3060 0.7180 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 2.3460 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -0.0840 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -0.8330 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 1.5930 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 3.8410 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 4.1290 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 8.2080 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 8.2200 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 12.3000 7.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 10.5700 6.7650 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 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 17 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 32 -1 M END