IBS-ZINC02586868 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.0930 0.0080 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 0.5180 3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 2.0960 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 2.6970 3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 4.1760 2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 4.7510 3.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 5.3790 4.9820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7160 4.6590 5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 5.8220 5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 6.4610 6.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 6.9600 7.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 6.6450 8.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4070 7.1340 9.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 7.8850 8.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8440 8.2050 7.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 7.7660 6.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 6.6300 7.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 5.4510 4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 5.6380 5.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 4.7940 3.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 4.3570 2.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 6.5700 4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 6.8150 5.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 7.9030 5.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 8.7590 4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 8.5060 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 7.4120 3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 9.9260 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 10.1440 4.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 10.7500 2.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 11.8770 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -1.0420 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.4890 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 0.0800 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 0.9560 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -0.5420 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 1.0230 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 2.1900 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 2.6280 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 2.1660 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 2.6040 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 4.7070 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 4.2690 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 6.0300 9.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 6.8970 10.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5070 8.8230 6.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 8.0350 5.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 7.0880 8.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.1520 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 8.0930 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 9.1640 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 7.2130 3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 12.4580 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 12.5080 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 11.5120 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 0.6770 2.1970 N 0 0 0 0 0 0 0 0 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 1 56 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 17 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 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END