PUBCHEM-ZINC04185031 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 0 0 0 0 0 0999 V2000 1.5330 0.9720 2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 1.3220 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.0330 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 0.3920 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 0.0430 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 0.3340 1.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 0.1000 2.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2770 0.1170 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 1.4810 3.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8070 2.1110 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1890 3.2450 2.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 1.1640 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 1.8830 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 3.0130 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1590 2.4550 -0.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1390 1.6860 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4060 0.5660 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3300 2.6430 -2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5710 3.3700 -2.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 1.9730 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 2.5440 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1850 1.6870 -4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1700 0.4560 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9360 0.3080 -2.6150 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2290 2.0680 5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6980 1.7980 5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3200 1.1760 4.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3210 2.2470 6.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7490 1.9840 6.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1970 2.5880 7.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1370 1.8420 8.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5480 2.3950 10.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0200 3.6960 10.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0790 4.4420 9.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6730 3.8860 7.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4210 4.2370 11.3830 F 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 1.1950 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 1.8200 4.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4740 1.3070 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -0.4550 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 0.0630 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -0.1210 4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 -0.5980 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 1.1760 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 2.3010 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 3.4560 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 3.7740 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8810 1.2540 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6310 2.3430 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1030 0.0560 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0030 -0.1460 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1230 3.5660 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8960 1.9840 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8500 -0.3360 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0570 3.1440 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6630 1.6240 5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8230 2.7440 6.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9210 0.9080 6.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3150 2.4280 5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 0.8270 8.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5000 1.8120 11.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4470 5.4570 9.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7230 4.4660 6.9400 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 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 25 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 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 63 1 0 0 0 0 M END