NIH-ZINC04216238 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0050 1.3160 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.0020 0.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -0.4050 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -1.6770 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -1.7560 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.6080 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 0.6560 -0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 0.6840 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 1.7770 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 3.1590 -0.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7000 3.2160 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 3.7740 -1.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7760 3.5350 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 5.2620 -1.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3140 5.9210 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 5.3200 0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2850 6.0050 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 4.0010 0.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 5.6920 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 5.8320 1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 5.0320 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 5.7300 -0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 5.5440 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 3.4770 -2.3580 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2450 -0.7460 -0.2050 F 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -2.8420 0.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 1.9860 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 6.6450 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 4.9220 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -2.7800 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -3.7250 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 26 30 1 0 0 0 0 26 31 1 0 0 0 0 M CHG 1 24 -1 M END