NIH-ZINC04465108 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.0570 1.0700 0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.1790 0.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -0.6660 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 0.0510 0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 1.4990 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 2.2270 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 3.0080 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 2.2520 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 1.8620 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -2.0480 -0.6940 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4150 -2.1980 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -2.1930 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -2.7170 -1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.6820 -3.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 -3.0050 -3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -2.1220 -4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -1.7960 -3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -1.2110 -3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -0.9600 -5.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -1.2820 -5.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -1.8540 -5.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -3.0220 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 0.9960 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 1.8510 0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 1.3160 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 1.8340 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 1.5040 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 2.9170 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 2.9840 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 4.0370 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0330 1.3620 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 2.9060 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 2.7050 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 1.0010 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -3.1070 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -0.9570 -3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -0.5070 -5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -1.0780 -7.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -2.1030 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -2.9470 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END