NIH-ZINC04039270 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 2.7360 1.3590 3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 1.8190 3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 1.0400 3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 1.8580 3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 3.0760 3.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 3.8400 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 3.0660 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 4.2030 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 4.0770 3.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 5.3890 4.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 6.4700 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 1.4520 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.3780 2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -1.4320 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -2.9190 3.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5810 -3.2680 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -3.5510 4.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -2.5770 5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -2.7550 6.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.2580 5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.0660 5.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -4.9880 5.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -5.3890 5.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 -7.2110 5.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -8.7060 5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -9.4480 4.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -9.1040 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -7.6130 4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -3.2310 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -3.6320 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -3.8590 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -3.6420 1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -3.1140 3.2660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.6760 1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 1.5280 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 1.9200 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 0.2960 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 6.1810 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 6.6750 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 7.3640 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 1.1570 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 2.2930 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 0.6140 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -5.2190 5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -5.5410 4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -5.1590 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -4.8360 5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -6.6380 6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -7.0050 4.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -9.0040 6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -8.9030 6.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -9.6900 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 -9.3130 5.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -7.4130 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -7.3340 4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -3.7710 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -4.1880 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -3.7670 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -0.1340 6.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -6.8300 5.3540 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 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 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 1 0 0 0 0 21 59 1 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 60 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 M END