IBS-ZINC04870168 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2100 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0180 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.3970 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.5630 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 4.3960 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 5.7240 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 5.7000 -0.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 4.3710 -0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 4.0760 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 3.9680 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 2.7030 1.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 2.2970 2.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 0.9840 3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 0.1550 2.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 0.5470 4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 -0.9170 4.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -1.7400 3.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 -2.9760 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 -2.9180 4.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 -1.6920 4.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5940 -4.1360 3.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.0340 -0.0190 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -0.5170 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 1.9420 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 6.6120 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 4.7060 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 2.9600 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 0.9410 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9250 5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2710 -4.0730 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 -5.0050 3.5610 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 M END