NIH-ZINC04039387 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.1400 1.4210 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -0.0200 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -0.5850 0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -1.8590 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -2.4800 1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -2.4960 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -3.7710 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 -3.9680 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 -2.7850 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -1.9040 -0.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -0.9950 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -2.5300 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4990 -5.1960 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0430 -5.5840 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -4.8090 2.5230 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9870 -4.6420 2.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -5.6290 3.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -6.7650 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7430 -7.6530 3.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7330 -6.7730 1.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -7.6610 0.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 -5.2680 4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2540 -4.5060 5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5980 -3.2140 6.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6720 -5.3420 7.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7240 -3.4890 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0160 -2.2980 2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -1.1070 2.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0070 -1.0960 2.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7130 -2.2100 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0990 -3.4380 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7080 -5.9430 -1.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -4.7790 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 1.8460 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.4330 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 2.0120 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -0.6110 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -0.0320 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -2.0530 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1820 -1.8770 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 -3.4760 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 -6.1730 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 -4.6370 5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2150 -3.6010 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0740 -5.1380 4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5050 -3.6830 6.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3920 -2.3060 6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7360 -2.9630 7.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7910 -5.9820 7.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5440 -5.8880 6.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8290 -5.0460 8.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -2.3000 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -0.1750 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7840 -2.1610 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6820 -4.3470 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -6.7300 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -4.6880 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -5.7840 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -4.5940 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4700 -4.1450 6.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 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 10 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 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 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 60 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 60 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END