IBS-ZINC02401596 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.5580 2.0110 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 0.4990 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -0.1560 1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -1.6680 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.3230 2.8030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9220 -2.0410 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -3.8220 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -4.4490 2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -1.8730 2.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -1.5680 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -1.8820 3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -2.2640 4.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 -1.4190 3.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9360 -0.4120 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 -2.3690 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 -1.4120 4.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 -0.5690 4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 -0.4320 6.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3100 0.4110 6.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7890 1.1430 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 1.0080 3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 0.1430 3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6470 1.7190 2.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6870 2.5520 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 3.1740 2.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3530 2.7360 4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 2.0570 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5590 2.2010 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9480 2.8280 6.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8340 4.0960 5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5230 3.6830 4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 2.4140 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 2.4780 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 2.2200 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 0.0970 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 0.2900 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 0.2460 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.0530 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -2.0710 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.8780 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 -3.3760 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -2.3740 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -2.0340 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 -0.9970 7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7780 0.5140 7.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6310 0.0280 2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9290 2.8360 7.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6450 1.2180 7.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3180 3.0850 7.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6300 2.1230 6.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0310 4.7260 6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7760 4.6440 5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3970 3.1920 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2860 4.5700 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -4.4600 2.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -5.4210 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 55 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 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 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 55 56 1 0 0 0 0 M END