PUBCHEM-ZINC05493865 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.3730 1.9110 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 0.3840 -0.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7880 -0.0240 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.0410 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -0.4570 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -0.8460 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -0.8190 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -0.4040 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -0.0190 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.1190 1.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -0.3200 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -0.0850 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -0.8270 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -1.0980 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -1.5710 4.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -1.7770 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -1.5100 3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -1.0420 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6740 -1.7760 3.4240 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -0.9390 2.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0740 -1.7110 4.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 -3.3350 2.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -3.7490 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5830 -2.8710 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 -3.2820 -0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6950 -4.5660 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6290 -5.4460 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -5.0440 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -5.9110 2.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -7.2230 2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -2.3440 -1.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6570 -1.2120 -1.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8750 -2.7040 -2.9130 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4190 2.2180 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 2.2850 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 2.3190 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.4780 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -1.1710 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -1.1220 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -0.3820 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 0.3030 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -0.3060 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -0.9370 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -1.7810 5.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6640 -2.1470 5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -0.8390 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3800 -3.9620 3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -1.8670 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -4.8820 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -6.4490 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 -7.8100 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -7.1530 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 -7.7050 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M END