NIH-ZINC04167841 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.2150 1.3240 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -0.0730 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.0380 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 0.2410 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -0.6350 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -0.8600 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -0.9680 -0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -1.0970 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -1.9390 2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -2.0450 3.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -3.3040 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -3.7650 5.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -5.0070 5.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -5.7400 5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -5.2040 4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 -4.0100 3.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -3.0060 5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -2.5410 4.6530 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9240 1.1360 3.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -0.5030 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 2.0580 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 1.3130 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 1.6890 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.9920 2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 0.7390 3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -1.0570 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -2.1180 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -2.7810 2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -5.3930 6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -6.7010 5.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 -5.7330 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -0.0750 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 0.2010 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -1.4950 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -0.5470 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -2.9400 6.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 19 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 17 18 1 0 0 0 0 17 36 2 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 M CHG 1 18 -1 M END