PUBCHEM-ZINC06363118 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 1 0 0 0 0 0999 V2000 -0.2750 1.2430 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.0740 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.7750 0.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4390 -1.5060 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -1.5220 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -0.9940 -2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.1730 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 0.6200 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 0.2660 2.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 1.5900 1.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8920 2.3170 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 0.7740 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 1.7750 -0.1300 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 2.8990 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 2.2960 2.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 3.5030 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 4.1360 1.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 3.9650 3.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 5.2620 4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 5.6450 5.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 6.9860 5.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2290 7.8010 5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 7.3510 7.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 7.6090 7.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 1.9810 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 1.6070 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -0.7500 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 0.4490 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 0.2680 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -0.0040 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 1.8360 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 4.1050 4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 3.1690 4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 5.1440 3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 6.0700 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 5.6870 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 4.8560 6.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.5570 -1.3440 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9620 7.3390 7.9490 O 0 5 0 0 0 0 0 0 0 0 0 0 8.1510 6.9500 5.0990 N 0 3 0 0 0 0 0 0 0 0 0 0 8.3050 7.6090 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 6.0160 4.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6930 7.3090 5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 7 8 1 0 0 0 0 7 28 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 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 40 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 M CHG 1 38 -1 M CHG 1 39 -1 M CHG 1 40 1 M END