PUBCHEM-ZINC03074980 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.4580 1.1080 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -0.3800 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -0.6830 0.9990 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8380 -0.0300 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -2.1210 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -2.8750 0.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -0.4520 -0.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -0.1570 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 -0.1560 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 0.1650 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 0.5150 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 0.6970 -4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 0.0730 -5.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 0.2480 -6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 1.0400 -6.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7600 1.6620 -5.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 1.4910 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 1.2230 -8.2580 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5190 0.6780 -9.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1590 1.9190 -8.6180 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8790 0.1090 -3.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -1.0420 -3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -2.0560 -2.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -1.0720 -4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -2.2630 -4.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.2840 -5.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.1290 -5.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 0.0550 -5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 0.0880 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 1.3240 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.3640 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 1.6980 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -0.9700 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.6370 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -0.5110 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9620 0.6600 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -0.5450 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -0.2330 -7.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5850 2.2790 -6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 1.9730 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 0.8980 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -3.1660 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -3.2050 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -1.1510 -6.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 0.9530 -6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 1.0120 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -2.5630 2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -3.4930 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 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 47 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END