NIH-ZINC03894648 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.4400 0.3440 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -0.7730 -0.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9410 -0.9540 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -2.0520 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -3.1680 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -2.7520 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -1.4720 -2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.3560 -1.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0960 0.5550 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -0.1120 -1.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 0.7160 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 1.2600 -3.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 0.9670 -2.5080 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5660 0.3510 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 2.4430 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 2.7880 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 3.9350 -1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 4.3130 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 3.5470 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9460 2.4060 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6300 2.0220 -3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 0.7500 -3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 0.6460 -3.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 0.1880 -5.0990 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -0.4130 -6.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -0.5660 -4.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 1.7470 -5.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 0.5250 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 1.2550 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 0.0470 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -1.8700 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -2.3490 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -4.0800 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -3.3500 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -2.5700 -2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -3.5470 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -1.1750 -3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -1.6540 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -0.5470 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 3.0550 -2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 2.6520 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 4.5350 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 5.2060 -1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4730 3.8410 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5810 1.8080 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 0.7620 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 -0.1060 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 2.3750 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 1.5370 -6.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 2.2640 -5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END