NIH-ZINC04960107 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.8040 1.1450 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.3550 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -2.0530 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 -2.3230 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -0.7330 -3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -0.4640 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -2.4320 -4.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4720 -1.7830 -4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -3.8710 -4.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 -4.3220 -5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -5.6860 -5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -6.3430 -4.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -5.2100 -4.1940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.2170 -6.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4280 -1.1690 -6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.6000 -7.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -3.0540 -5.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -2.7020 -6.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -1.6900 -7.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -3.5460 -6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -4.7080 -5.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -5.4940 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -5.1330 -6.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -3.9790 -7.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -3.1800 -7.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -3.6300 -7.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -4.4970 -7.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 1.7040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 1.4150 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 1.3840 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.6250 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.9140 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -2.7520 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -2.1830 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -1.6420 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -3.3520 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -0.6040 -4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -0.0340 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 0.5660 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -1.1440 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -3.6720 -5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -6.1820 -5.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -7.4070 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -2.3440 -8.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 -2.0580 -7.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -3.6730 -7.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -3.8610 -5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -4.9930 -5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -6.3930 -5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -5.7520 -6.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -2.2800 -7.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 -5.4920 -7.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 -4.5580 -6.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2110 -4.1040 -8.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.6770 -1.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -2.1100 -3.6340 N 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 31 1 0 0 0 0 2 32 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 55 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 56 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 55 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 7 56 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 M END