NIH-ZINC04039873 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.3150 1.4480 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 0.5900 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.4530 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.9680 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -0.2880 0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -0.4460 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 0.6680 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 1.6100 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 2.4140 -1.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 1.5840 -0.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 2.5440 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -2.0980 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.9040 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -2.0770 3.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0690 -1.6050 4.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8390 -2.0990 5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -1.9760 5.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -2.5940 4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -3.0030 5.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -2.7160 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -3.2230 2.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -1.7040 6.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.3370 7.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 1.3270 8.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -1.0010 9.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.1100 4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 0.4240 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 1.7940 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 2.6350 4.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 2.0970 4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 0.7260 4.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 3.9830 4.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 4.7870 4.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.3330 2.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 2.3290 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 1.7600 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 0.8770 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 2.3840 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 3.5550 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 2.4160 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -3.0500 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -2.0240 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -2.0390 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -2.4760 7.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -1.7040 7.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 0.4340 6.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -0.3370 6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 1.5130 8.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 2.0000 8.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 1.5020 9.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -2.0220 9.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -0.9000 8.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -0.7780 10.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -0.2310 4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 2.2110 4.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 2.7490 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 0.3060 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 4.5630 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 4.5700 5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 5.8410 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -2.8070 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -0.0650 8.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 34 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 61 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 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 62 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 62 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 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 M END