NIH-ZINC02938694 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 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 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2400 -3.5810 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -2.5370 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -3.3240 5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -3.8440 6.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 -3.4490 5.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -4.2130 6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 -5.2720 5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6380 -4.5940 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 -3.8960 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9340 -2.8300 4.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4520 -3.6320 5.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8270 -4.0210 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7660 -4.9150 3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4930 -5.5820 3.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -1.8400 5.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.3550 6.5130 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -1.4930 7.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -2.5360 5.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -3.9540 7.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -4.0810 8.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -5.3350 8.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -6.4640 8.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -6.3360 6.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -5.0810 6.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -7.6900 8.5210 F 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 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 -2.9860 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -1.5080 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 -3.5410 6.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 -4.7010 6.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 -5.7790 6.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -5.9980 5.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5030 -3.4290 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2040 -4.6290 2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 -2.4050 3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5570 -2.0450 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4540 -3.1460 4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1890 -4.5890 5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 -4.3100 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5850 -5.6340 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -1.0680 5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -3.2000 8.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -5.4340 9.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -7.2160 6.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -4.9810 5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 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 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 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 17 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 20 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 M END