NIH-ZINC02938514 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 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 2.7040 -2.6650 4.5050 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -1.7400 5.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -3.9690 4.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -2.8640 4.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -1.6920 3.8700 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7540 -0.8510 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 -2.0090 4.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 -2.2420 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 -2.1630 6.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7130 -2.5390 6.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7100 -2.7650 7.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 -2.4670 8.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 -3.7800 9.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 -4.8870 8.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 -4.2490 8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -1.3390 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -0.0950 1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 -0.2270 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2260 -1.5450 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -2.2140 1.3870 O 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 4.6550 -3.7560 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -2.9040 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 -1.1700 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 -2.6020 5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -2.1300 8.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7800 -2.1540 7.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0300 -1.6880 9.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6740 -3.9000 8.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3760 -3.7990 10.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2650 -5.1010 7.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7520 -5.7910 8.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 -4.3430 9.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 -4.7100 7.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0960 0.8280 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 0.5750 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 -1.9900 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 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 34 1 0 0 0 0 8 35 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 M END