NIH-ZINC02972632 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.1250 -0.8710 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.7100 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -0.6850 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.8280 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.9710 -1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -0.9970 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -0.8060 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.2260 1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9130 -1.4670 -0.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 -1.5940 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 -0.2610 0.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6940 0.4730 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5720 -0.3690 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3260 -1.4630 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7050 -1.4870 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 -0.4120 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6080 0.6600 -0.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2730 0.6560 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 1.7930 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1810 2.3150 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 1.5310 4.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 0.0760 4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 -0.4400 2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 2.1270 5.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 3.3310 5.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0950 3.9380 7.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 3.3560 7.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 2.1710 7.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 1.5750 6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 0.4550 5.6950 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -0.8930 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -0.6070 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -0.5620 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -1.0410 -2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -1.1100 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -1.9410 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 -2.2960 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -2.0860 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8610 -2.3060 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3050 -2.3240 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3660 -0.3820 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7680 1.5410 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4060 2.2730 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 1.9740 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 3.3770 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 2.2410 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 -0.4620 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -0.1580 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2640 -0.2480 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 -1.5080 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 3.8020 5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 4.8620 7.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5300 3.8260 8.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 1.7080 7.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6490 0.2880 1.6640 N 0 3 0 0 0 0 0 0 0 0 0 0 5.6030 0.1440 1.6830 H 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 55 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END