NIH-ZINC04057080 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.0410 -3.1820 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -4.2720 1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -4.0790 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -5.1720 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -5.1090 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -3.9530 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -2.8630 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -2.9200 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -3.8850 -2.7560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3190 -2.6370 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 -2.8810 -5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 -5.2860 -4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 -5.0370 -3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4510 -4.1560 -6.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5250 -3.1230 -7.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8410 -4.8040 -7.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -3.9340 -6.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2830 -3.3230 -5.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 -3.4430 -4.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5100 -2.5050 -5.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1800 -2.4350 -4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3390 -1.6670 -4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8250 -0.9570 -5.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1420 -1.0140 -6.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9850 -1.7820 -6.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7220 -0.1160 -8.0160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -4.8290 -7.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 -6.2190 -7.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -6.7670 -8.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -5.9070 -8.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -4.5630 -8.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -4.0600 -8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -2.9230 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.3140 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -3.4950 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -6.0850 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -5.9820 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -1.9460 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -2.0410 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -1.8710 -3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -2.2350 -3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -3.1590 -5.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -1.9840 -5.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 -6.0690 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -5.5650 -4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 -4.8220 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -5.9570 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -5.7060 -6.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 -5.1020 -8.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 -3.8210 -7.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8080 -2.9820 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8630 -1.6210 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7280 -0.3590 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4600 -1.7820 -7.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -6.8950 -7.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -7.8410 -8.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -6.2850 -9.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -2.9730 -8.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2290 -4.0180 -5.3890 N 0 3 0 0 0 0 0 0 0 0 0 0 6.1720 -3.7420 -5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 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 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 11 59 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 12 59 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 14 59 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 18 1 0 0 0 0 17 50 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 32 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END