NIH-ZINC06545965 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 1.1770 -0.9190 -2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -1.0890 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -1.6450 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -1.8590 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -1.5820 1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -2.4070 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 -3.7300 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -4.2580 -0.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3610 -3.5300 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.0890 -0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3330 -2.1960 0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -1.5300 0.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9750 -1.0280 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -0.4740 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 0.7850 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 1.5770 -1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 0.9620 -2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 -0.7120 -2.5240 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -4.6390 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -6.6360 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -7.6430 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -6.9460 3.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -5.8970 3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -4.8890 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -7.8480 4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -7.3880 5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -8.2800 6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -9.6320 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -10.0930 5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -9.2040 3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -10.5030 7.3270 F 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -0.4950 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -1.8900 -2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.2500 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -1.7570 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.1180 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -5.2140 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -1.6880 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 1.1570 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 2.6140 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 1.4210 -3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -5.1900 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -4.0430 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -6.1860 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -7.1450 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -8.1130 1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -8.4070 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -6.3470 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -5.3870 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -4.1260 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.4200 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -6.3340 5.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -7.9230 7.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -11.1480 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -9.5630 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -5.5860 0.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END