NIH-ZINC03960542 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 0.1620 1.6780 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 0.3730 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -0.3980 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 0.1360 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 1.4410 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 2.2130 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -0.7040 -0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4530 -1.7380 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -0.6370 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 0.2220 1.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9990 -1.5330 2.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -1.4190 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -1.4890 4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -2.7030 4.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -2.6730 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 -2.6480 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -2.8870 5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -3.9880 5.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -4.1580 6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -3.2200 7.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -2.1520 7.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -0.1960 -1.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 -0.8660 -2.5500 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -0.1410 -3.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 -2.2740 -2.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -0.5240 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 0.2740 -4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.5660 -5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 0.0640 -4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.7800 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -1.0900 -2.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -1.8890 -1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -2.2060 -1.6280 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -1.3820 -2.8250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 2.2790 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -0.0440 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.4180 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 1.8590 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 3.2320 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -2.2390 3.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -0.4660 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.5160 5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -0.6120 4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.5600 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -1.7800 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -2.5080 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -3.5890 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -4.6980 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -5.0020 6.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -3.3240 7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -1.4200 8.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 0.5340 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 0.6960 -4.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 1.2080 -5.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 0.3060 -5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -2.0170 6.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 56 2 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 34 2 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 M END