PUBCHEM-ZINC00627545 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.3010 1.0690 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.2340 -0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.6080 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -1.8920 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -2.4000 1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -1.6280 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -0.3450 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 0.1630 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -2.2130 4.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -1.6180 5.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -0.4430 5.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -2.4850 6.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -3.8720 6.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -4.6880 7.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 -4.1250 8.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -2.7430 8.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -1.9030 7.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 -0.4940 7.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 0.2700 8.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 -0.1660 8.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 1.7680 7.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6040 2.0070 7.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 2.0090 6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 3.4800 6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 4.3450 7.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 4.1410 8.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 2.6640 8.9300 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2880 2.3420 9.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 2.6270 10.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 2.0510 10.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 1.8390 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.2130 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 1.1730 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -2.5040 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -3.4030 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 0.2940 3.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 1.1670 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -3.1590 4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -4.3420 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -5.7610 7.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 -4.7570 8.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 -2.3460 9.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 0.0080 6.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4110 1.6470 6.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 1.4270 5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9340 3.6100 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3470 3.8080 5.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0550 4.1010 7.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9330 5.4000 6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7900 4.7510 9.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 4.5250 8.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 3.1960 11.2340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 52 -1 M END