IBS-ZINC02091905 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.2320 0.9920 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -0.3810 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -0.6260 -0.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1170 0.1870 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -1.9310 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -2.8190 -1.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -2.1070 -1.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 -3.2990 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -4.3300 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 -5.5340 -1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -5.7330 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -7.0210 -3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -7.1480 -5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -6.0610 -5.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -6.1810 -7.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -4.8940 -5.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -4.6980 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -3.4790 -3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.3560 -4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -8.1430 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -9.3200 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -10.3620 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -10.2440 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -9.0810 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -8.0280 -1.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -0.6850 -0.7020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -0.0900 -1.9240 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -0.2180 -1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.6710 -3.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 1.6380 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 2.5380 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 3.8930 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 4.3500 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 3.4500 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 2.0940 -2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 5.8270 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 0.9940 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 1.7550 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 1.2050 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -1.1530 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.4130 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -4.1750 -0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -6.3300 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -8.0760 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -2.4190 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -2.4360 -5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -1.4000 -3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -9.4130 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -11.2730 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -11.0630 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -8.9950 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -7.1190 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -1.0720 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 2.1810 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 4.5960 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 3.8060 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 1.3920 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 6.2480 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 5.9870 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 6.3160 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 2 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 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 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 36 58 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 M END