IBS-ZINC04137467 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.0140 1.4690 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0320 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -0.6120 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -1.9880 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.7850 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -2.2060 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -0.8290 -1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.2860 -0.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6250 -4.5740 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -4.8210 -0.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4990 -5.7380 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -5.7000 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -6.3220 -3.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -4.8900 -1.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -4.6400 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 -5.6620 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -4.1220 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -6.5070 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -6.3740 -1.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 -3.6880 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -3.3540 -1.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -2.9870 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -3.3700 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -2.7100 3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -1.6700 3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -1.2820 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -1.9320 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -0.2590 1.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 0.3710 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.8210 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 1.7550 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.9160 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 0.0110 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -2.4410 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -2.8280 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -0.3760 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -4.7320 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -3.6350 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -5.5710 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -6.6680 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -4.1260 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 -3.3200 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 -3.9610 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -7.4400 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 -6.5980 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 -6.2960 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -5.3790 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -4.1820 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -3.0070 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9130 -1.1580 4.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -1.6280 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 -0.3650 3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 0.7900 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 1.1690 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -5.4120 -1.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 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 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 55 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 55 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END