IBS-ZINC05253074 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.1670 1.4540 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.0080 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.6260 1.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0660 -1.1520 0.7240 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8580 -0.9980 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -2.1500 1.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3490 -2.9810 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -3.5050 0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -3.1170 -1.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -2.2590 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -1.2640 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -0.4170 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 -0.5670 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -1.5750 -3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -2.4260 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -2.8870 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -2.7770 3.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 0.0850 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.7100 2.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 0.1460 3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 1.1170 4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 1.2360 4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 0.3740 4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 -0.5910 3.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.7080 2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 0.5140 5.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 1.5770 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 1.8440 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 2.0720 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -0.0810 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.5500 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 0.3670 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 0.0990 -2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -1.6930 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -3.2070 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.7920 4.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 2.0010 5.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -1.2730 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -1.4990 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 1.2070 4.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -0.4540 5.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1370 0.8910 6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -3.6020 2.3520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 18 19 2 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 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M CHG 1 43 -1 M END