IBS-ZINC04040505 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1400 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4800 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -1.8710 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.6350 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0090 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.7520 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -4.1720 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -2.5390 4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -1.8970 5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -2.8560 6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -4.0620 5.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -4.9260 5.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -3.8340 4.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -2.6300 7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 -1.5430 7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -1.3360 8.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 -2.2060 9.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 -3.2870 9.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -3.5020 8.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -4.5610 8.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 -0.2830 9.0660 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.2180 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1120 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -3.7130 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -4.4700 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -4.4880 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -4.6430 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -0.8340 5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3650 -0.8640 6.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -2.0400 10.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 -3.9610 10.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -5.3670 8.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 M END