NIH-ZINC03045548 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.6160 -4.5800 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 -1.6700 -5.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -3.9100 -4.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.8480 -5.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -1.6950 -6.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.1530 -7.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -0.9660 -8.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 0.1370 -7.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -1.1320 -9.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 0.0220 -10.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -0.4510 -10.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 0.3390 -10.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 1.7430 -11.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 2.5920 -10.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 2.9180 -11.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 1.6610 -11.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 0.7240 -10.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -3.7480 -5.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -1.2420 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -0.9630 -6.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.6060 -8.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -2.8850 -7.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -2.0140 -9.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 0.7180 -9.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -0.2890 -11.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -1.5130 -10.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 -0.1720 -10.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 0.4120 -9.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 1.6760 -12.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 2.2040 -11.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 3.5180 -10.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 2.0390 -9.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 3.6970 -11.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 3.2680 -10.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 1.1530 -12.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 1.9410 -12.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 1.3020 -10.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -0.0210 -11.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 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 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 M END