NIH-ZINC06577661 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8450 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -2.5720 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.4270 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -3.8150 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -4.3530 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -3.5190 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 -2.1360 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -1.5910 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -4.0680 0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 -3.0220 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0610 -3.5490 -0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9220 -2.8110 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5420 -1.7770 -1.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3430 -3.2580 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8360 -3.9640 0.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.7870 -4.4570 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8110 -4.9900 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4810 -4.7420 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3270 -6.0030 0.8640 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.8650 -4.9820 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2320 -6.2270 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5670 -7.2090 1.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0150 -2.9540 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1630 -2.6960 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0840 -1.7250 2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8730 -1.1940 3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7400 -1.9390 1.9680 S 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 0.5120 -0.3560 -0.8950 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 -2.1750 -4.4630 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 -5.4260 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -1.4910 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -0.5190 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6580 -2.4940 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5020 -2.3160 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9720 -2.3920 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3890 -3.9490 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -5.6190 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0100 -4.4080 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0840 -3.2070 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9400 -1.4210 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6250 -0.4260 3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 3 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 M END