IBS-ZINC06719541 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.0690 1.6290 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.1240 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.5210 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.0210 1.2190 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7300 -2.3010 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.5950 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -1.8900 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -2.6950 -2.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -3.9170 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -3.8950 -0.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -5.3240 -2.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -4.6790 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -0.5420 -1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -2.5420 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -3.2390 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -3.6130 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -3.2210 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -2.3330 0.6570 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 0.2440 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 0.3810 3.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 0.8230 2.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 1.4880 3.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 1.0320 4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 1.6910 6.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 2.8030 6.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 3.2590 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 2.6010 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 1.9430 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 2.0100 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 2.0220 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -3.8680 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -4.3050 -4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -5.4760 -4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0880 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -3.4910 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -4.1800 3.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -3.4210 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 0.7780 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 0.1640 4.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 1.3370 7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 3.3160 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 4.1280 5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 2.9550 3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 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 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END