IBS-ZINC02396849 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0720 1.5500 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.0440 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -0.6060 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -1.9880 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -2.7200 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.0700 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.6880 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.4800 0.1660 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -4.9220 -1.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -4.8360 1.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -4.9770 0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -4.7250 -1.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7860 -4.6290 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 -3.4500 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -2.5720 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -1.4020 -1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 -1.1120 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -1.9900 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -3.1620 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -5.8730 -1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -6.8060 -0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -5.8590 -2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -6.9700 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -7.9570 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 -9.0910 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 -9.2250 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -8.2180 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -7.1100 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 -5.8640 -0.7900 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -10.4270 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8800 -11.3680 -4.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 -11.1690 -4.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 -12.0210 -5.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -10.0650 -4.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6720 -10.6150 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.9160 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8800 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 1.9420 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -0.0340 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -2.4950 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.6420 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.1810 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -5.4350 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -2.7990 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 -0.7160 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2240 -0.1980 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -1.7620 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -3.8500 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6080 -7.8430 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9200 -8.3200 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4500 -12.2670 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4730 -10.1940 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8540 -11.6790 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6450 -10.1090 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 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 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 48 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 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 34 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 30 31 2 0 0 0 0 30 35 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 35 54 1 0 0 0 0 M END