IBS-ZINC04723666 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.6290 1.1880 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.0040 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -0.6190 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -1.7810 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.4050 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -1.8710 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -0.7080 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -0.0870 1.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -2.5030 4.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -1.7690 5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -0.5540 5.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -2.4360 6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -1.6800 7.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 -2.3180 8.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -1.6860 9.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -2.6920 9.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -3.8960 9.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 -3.6520 8.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -5.2320 9.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 -5.3500 11.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -6.5990 11.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 -7.7380 10.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 -7.6340 9.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -6.3780 9.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -8.8550 9.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3620 -8.7630 8.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0080 -3.8660 6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -5.0000 6.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 0.9630 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 1.5760 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 1.9340 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -2.1970 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -3.3090 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -0.2920 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 0.8150 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -3.4700 4.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -0.6020 7.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -0.6210 9.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 -2.5530 10.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -4.4640 11.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 -6.6850 12.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6290 -8.7110 11.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 -6.2920 8.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 -10.0690 9.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0800 -10.8380 9.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 27 28 3 0 0 0 0 44 45 1 0 0 0 0 M END