IBS-ZINC06665112 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 1.8860 -2.1930 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -1.1060 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -1.6350 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -0.7160 1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.0890 2.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.7190 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -2.0250 3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -2.3450 4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -1.3640 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -0.0590 4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 0.2760 4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 1.4350 3.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 1.2200 2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 2.2700 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 2.9810 1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 4.1120 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 4.4260 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 3.5110 -0.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 2.6460 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 -1.7020 5.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -3.0680 6.7540 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -3.0980 7.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -4.0950 5.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -2.7440 7.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -3.0360 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -2.5260 3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.7910 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.2310 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -2.5100 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -0.8600 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -1.9120 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -0.0140 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -1.6080 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -2.7900 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -3.3610 4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 0.6980 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.9770 3.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 1.7930 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 4.6490 2.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 5.2660 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 1.8010 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -1.1360 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -1.8600 8.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.6020 8.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -2.5770 7.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END