NIH-ZINC06191411 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.3250 1.6390 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 1.4850 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 0.5320 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -0.2710 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -0.1210 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 0.8420 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6440 -0.9780 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -1.7320 -2.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -1.4830 -0.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 -1.3090 1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -2.7100 -0.4080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -1.0900 -1.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 0.1770 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 0.1420 -2.3390 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0260 -0.0050 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 1.4650 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1940 1.4780 -3.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9650 2.5910 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9150 2.6710 -4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6980 3.8020 -4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5360 4.8550 -3.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5900 4.7770 -2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8000 3.6500 -2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6100 6.4020 -3.9120 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.3640 -0.9340 -2.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 2.3810 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 2.1110 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 0.4180 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 0.9630 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -1.6980 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 0.9980 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8020 0.3240 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 2.2920 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7510 1.5700 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0420 1.8490 -5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4370 3.8650 -5.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 5.5990 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0580 3.5910 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -0.8690 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -0.9220 -3.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -1.5010 -4.0570 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 25 39 1 0 0 0 0 40 41 1 0 0 0 0 M END