NIH-ZINC00441482 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.4600 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0450 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.6630 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.1770 1.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6980 -2.5410 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.8550 -0.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.0990 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.6490 -2.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.7620 -1.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -2.5890 1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -3.0860 3.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -3.3940 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -3.1470 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -2.4950 1.1620 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 0.0800 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 0.3530 2.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 0.4830 2.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 1.1610 4.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 2.4850 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 2.2140 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 1.5880 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 0.2580 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.8640 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.7710 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.8330 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -3.8220 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.2740 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -3.2370 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -3.8030 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -3.3240 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 0.5300 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 1.3570 4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 2.9520 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 3.1500 3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 1.5290 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 3.1520 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 1.4160 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 2.2610 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.1400 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -0.4480 2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END