NIH-ZINC03894716 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2090 -0.6720 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0340 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4110 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0810 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 2.2430 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 1.4310 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 0.1340 -0.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.7570 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -0.2210 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7230 0.5340 -1.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 -1.5570 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 -1.7100 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 -3.0080 -3.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -3.3010 -4.7210 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 -4.6400 -5.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7230 -2.1870 -5.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5430 -3.2670 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2240 -4.3210 -3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5240 -4.0520 -3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8990 -2.7790 -3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5680 -1.8380 -4.1040 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5590 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -1.7520 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 2.5840 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 3.1090 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 1.9620 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 1.2740 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -1.2150 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -1.5350 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -2.3540 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -1.6170 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -0.9130 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 -1.6500 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -3.6970 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7930 -5.3100 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1850 -4.8150 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8730 -2.3860 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 M END