NIH-ZINC01078538 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.1190 1.5680 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.0440 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -0.5490 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 0.1750 -3.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.0040 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -2.5580 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -3.9180 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -4.7460 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -4.2010 -1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -2.8420 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -6.0910 -2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -6.8830 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -8.3630 -1.8260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5080 -8.6230 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -9.2180 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -11.1360 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -11.4440 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -12.9140 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -13.7530 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -13.2670 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 -11.7980 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -10.9580 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -8.6050 -1.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 1.9530 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 1.8390 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 1.9970 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.2260 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -0.3410 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.9160 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -4.3460 -4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -4.8490 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.4200 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -6.6010 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -6.7150 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -9.0390 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -8.9520 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -11.0820 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -10.5250 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -12.1710 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -11.3410 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -13.0170 -1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -13.2590 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -14.8000 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -13.6500 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -13.3710 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -13.8650 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -11.4520 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -11.6940 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -9.9110 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -11.0620 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -8.3950 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -10.6380 -1.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 52 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 40 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 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 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 M END