NIH-ZINC04165424 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6690 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.0370 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5520 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -3.7020 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.3300 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.4920 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.0950 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -1.0020 -5.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -1.6480 -6.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -0.5720 -7.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 0.5960 -7.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -0.9080 -8.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 0.1310 -9.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9000 -0.0970 -9.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 -1.5090 -10.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 -2.5480 -9.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -2.3190 -9.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 -1.9220 -11.6320 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 -3.2370 -11.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -0.8170 -12.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 -2.0340 -11.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1520 -3.2380 -10.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4990 -3.3280 -10.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3090 -2.2140 -10.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7710 -1.0090 -11.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4230 -0.9210 -11.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5620 0.0810 -11.1830 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.2690 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -4.7050 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -5.6220 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.1070 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.7050 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -2.7230 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -0.3920 -5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 -0.3750 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -2.2580 -6.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -2.2760 -7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 0.0670 -10.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2440 1.1140 -9.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2450 0.5380 -10.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 0.1400 -8.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7700 -3.5300 -9.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 -2.4840 -8.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 -2.9540 -8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -2.5610 -9.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5200 -4.1090 -10.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9180 -4.2690 -10.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3610 -2.2850 -10.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0040 0.0180 -11.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 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 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 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 21 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 58 1 0 0 0 0 M END