NIH-ZINC04057301 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 0 0 0 0 0 0999 V2000 -2.5660 1.7770 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 1.4910 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 1.8680 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 4.0080 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 3.6310 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 3.7230 4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 5.2040 4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 5.6160 5.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 7.0340 6.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 7.6210 7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 6.9740 8.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 9.0530 7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 9.8080 6.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 11.1620 6.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 11.7520 7.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 11.1020 8.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 9.7300 8.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 9.0540 9.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 9.7240 11.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 11.0730 11.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 11.7580 10.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 11.9070 5.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 13.2860 5.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 14.0340 6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 15.3960 6.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 16.0190 6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 15.2720 5.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 13.9060 5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 15.8830 4.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 15.0550 4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 17.3600 6.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 18.0640 7.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 0.7000 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 2.0410 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 2.2950 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.7980 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 0.4130 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 1.5380 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 1.3870 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 5.0870 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 3.7020 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 4.1120 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 3.9620 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 3.1240 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 3.5610 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 5.3660 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 5.8030 3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 5.4540 6.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 5.0180 6.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 7.5510 5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 9.3570 5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 8.0080 9.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 9.2020 11.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 11.5830 12.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 12.8040 10.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 11.4710 4.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 13.5500 6.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 15.9760 7.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 13.3250 4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 14.2910 4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 14.5760 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 15.6660 3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 17.6600 8.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 19.1220 7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 17.9450 6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 2.1730 0.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 3.3270 2.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 66 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 66 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 67 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 4 67 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 66 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 6 67 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 50 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 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 51 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 59 1 0 0 0 0 29 30 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 M END