NIH-ZINC02847210 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -5.2630 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -5.2770 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -4.0440 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -3.0660 0.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -4.0280 2.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -2.8260 3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -2.8020 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4170 -1.5710 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6330 -1.6460 2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 -2.8750 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1250 -0.4240 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0920 -1.8940 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -0.3270 5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8070 -1.7530 6.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 -6.2950 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -5.0700 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -4.5880 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -6.1190 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -5.5000 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -4.8090 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -1.9470 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1460 -3.7040 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -2.7810 5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -2.9040 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3400 -3.7770 2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2310 -0.6030 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7080 0.4530 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 -0.2540 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4780 -2.7830 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7050 -1.0330 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1230 -2.0420 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -0.2010 4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 0.5510 5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -0.4470 5.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -1.8440 7.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 -0.8880 6.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -2.6540 6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6310 -1.3980 4.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4410 -1.7850 4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 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 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 20 56 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 56 57 1 0 0 0 0 M END