NIH-ZINC03958804 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 0.5680 1.4800 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.0200 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.6980 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.0730 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -2.7760 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.0930 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.7170 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1670 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -4.8940 -1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2200 -4.2440 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -6.1120 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -7.2160 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -8.4960 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -8.6100 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -7.4670 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -6.2710 -1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -6.7320 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3650 -7.4430 -1.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -5.3890 -1.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -4.5570 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -4.1850 -2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -4.9980 -3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -4.6570 -5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -3.5020 -5.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -2.6880 -4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -3.0280 -3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -3.1680 -6.9030 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 1.7500 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 1.8810 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 1.8960 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.1510 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.6020 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.6360 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -0.1840 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.6520 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -9.3720 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -9.5820 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -7.5550 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -5.1140 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -3.6520 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -5.9000 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -5.2920 -5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -1.7870 -5.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -2.3920 -2.8830 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END