IBS-ZINC05427201 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.1020 3.8440 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 2.4410 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 1.4990 -1.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8500 1.9110 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 0.1290 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 0.5520 -3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 0.3090 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -0.0570 -6.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -0.1770 -6.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.2760 -7.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.5270 -8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -0.1490 -7.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -0.3530 -8.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 0.2010 -5.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 0.4370 -4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 0.8040 -3.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 0.7630 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 0.3250 -5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 1.5400 -6.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 1.6600 -5.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4460 0.5710 -5.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8380 -0.6400 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4670 -0.7680 -5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9420 0.7040 -5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 4.2100 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 3.8060 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 4.5150 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 2.4790 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 2.0760 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -0.5420 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 0.2360 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.2830 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -0.4040 -3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 1.0850 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 1.0840 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 1.3380 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -0.2700 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 2.3910 -6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 2.6040 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 -1.4890 -5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 -1.7150 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 0.4620 -6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 0.0200 -4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1960 1.7280 -5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 1.3550 -2.7070 N 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 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 45 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 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 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END