IBS-ZINC05197854 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.9110 1.1070 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -0.2890 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -0.9060 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -2.1720 1.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -3.2040 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -4.3610 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5740 -4.5040 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 -3.4720 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -2.2800 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -1.1390 1.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -0.3560 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.0410 2.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 1.0840 2.6680 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2830 1.6600 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 2.0590 3.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 2.5600 3.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.7920 4.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 1.1900 4.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0900 1.8220 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -0.1820 4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -0.6350 5.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -1.8930 5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -2.7000 5.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -2.2480 5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.9900 5.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -3.0360 5.7990 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 2.0670 6.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 3.4760 6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 5.1680 8.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 2.8810 8.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 1.7720 1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 1.8210 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 1.1780 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 1.3300 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -3.1010 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -5.1750 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -5.4260 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 -3.5700 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -0.0050 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -2.2450 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -3.6830 6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -0.6380 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 1.3390 6.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.9980 6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 4.2040 5.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 3.5460 6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 5.4210 7.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 5.7880 7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 5.3450 9.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 1.8390 8.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 3.0510 8.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 3.1060 9.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 1.6710 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 3.7520 7.8760 N 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 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 18 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 M END