IBS-ZINC04650255 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0230 2.4790 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 1.1300 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 0.4110 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 1.0460 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 2.3960 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 3.1120 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 4.5840 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 4.7690 1.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 4.8120 1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 4.6990 1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 4.9990 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 5.0530 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 4.7710 3.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 4.9450 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 4.5580 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 4.7400 4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 4.3780 3.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 5.1280 3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 5.2850 5.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 5.0660 3.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 4.8980 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 4.8560 1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.9080 -1.4600 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 3.0410 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 0.6350 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 0.4870 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 2.8920 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 5.0170 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 5.0790 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 5.3210 5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 4.4530 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.9870 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 4.3080 5.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 3.5160 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 5.1950 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4900 5.7820 4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 4.1030 5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3720 4.4690 3.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 5.1480 3.5240 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 23 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 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 21 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 18 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 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 M END