NIH-ZINC04042849 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0990 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7820 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0840 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6930 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0060 -2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.7760 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 0.1500 -4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 0.5920 -5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 1.4420 -6.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 1.8500 -6.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.4080 -6.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 0.5550 -5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8480 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -4.3550 2.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6160 -4.9160 3.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9840 -4.0990 4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -5.6900 4.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -5.6710 3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -6.2360 4.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -4.8670 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -4.6640 1.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -6.3950 5.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -7.8220 5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -7.9360 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -9.9640 6.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -5.8080 3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -5.3410 3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -6.1880 2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -7.4260 2.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -7.9040 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -7.1140 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.2540 3.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1660 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8620 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6130 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -1.3920 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.4170 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 0.2730 -4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 1.7870 -6.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 2.5150 -7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 1.7270 -6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 0.2060 -4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -6.4260 6.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -5.8720 6.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -7.7910 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -8.3460 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -7.9990 6.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -6.8920 7.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -8.4790 8.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -10.3930 5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -10.1000 5.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -10.4630 7.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -4.3280 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -5.8320 2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -8.9240 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -7.5100 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -4.7310 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -8.5300 6.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 35 2 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 63 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 64 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 64 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 64 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 M END