NIH-ZINC04521813 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -0.9640 1.5000 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -0.0300 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.5350 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.0650 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -2.5700 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -4.1000 3.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3060 -4.4440 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -4.5940 4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -5.4470 5.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -5.9410 5.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7570 -5.4810 5.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -5.6350 7.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -6.7540 8.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -7.9400 7.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -9.0900 7.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -7.4740 5.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2080 -7.8720 5.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -7.8890 5.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -9.3830 5.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -9.8850 4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 -8.9820 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 -9.5130 3.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7430 -8.5960 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 -9.1200 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5150 -10.1230 2.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -4.6080 3.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 1.8870 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 1.8600 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 1.8430 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -0.4160 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -0.3720 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -0.1480 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -0.1920 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -2.4520 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -2.4070 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -2.1830 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -2.2270 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -4.2460 4.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -5.7950 5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -4.6430 7.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -6.7850 9.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -7.3940 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -7.6000 6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 -10.0400 6.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -10.9450 4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 -8.9570 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 -7.9750 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5970 -9.5380 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9710 -10.5200 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 -8.5720 1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 -7.5890 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -4.3410 4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9430 -8.4710 0.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8240 -8.8450 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 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 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 26 52 1 0 0 0 0 53 54 1 0 0 0 0 M END