NIH-ZINC04093235 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 64 0 0 1 0 0 0 0 0999 V2000 0.3790 1.7650 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 0.4050 -1.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -0.4730 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.8980 -1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -2.8150 -2.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -3.3790 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -4.1140 -3.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -4.0230 -4.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -3.2360 -3.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -3.1530 -1.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0640 -3.2110 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -1.7660 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 -1.4140 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5540 -0.1010 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 0.8970 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 0.5470 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -0.7760 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 1.5580 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 2.8570 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 3.1010 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 2.1530 -1.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -4.0490 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 -5.1950 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 -6.4960 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -6.7910 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -5.6510 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 -7.4100 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 -8.7860 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0310 -9.7230 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 -9.3060 2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3950 -7.9520 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -7.0280 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -5.7390 2.6230 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 2.0690 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 1.9120 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 2.3870 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.3750 -3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -0.1970 -2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -1.9470 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -2.2530 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -2.1380 -3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 0.1560 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -1.0120 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 1.3460 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 3.6570 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 4.0970 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 -3.9650 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 -3.1100 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3130 -5.1950 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 -5.0040 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -6.9190 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 -7.7160 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -5.8310 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -5.5630 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 -9.1520 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -10.7800 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 -10.0320 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6920 -7.6070 4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -4.2980 -1.1850 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1260 -4.3790 -2.1090 H 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 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 9 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 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 59 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 59 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 31 58 1 0 0 0 0 32 33 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END