IBS-ZINC02353627 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.5890 3.1250 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 2.9460 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 3.4020 3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 2.7980 3.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 2.2880 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 1.6730 2.8480 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 2.1050 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 2.7030 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 3.1560 5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 3.6860 6.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 2.9440 6.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 2.3620 6.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 2.2120 7.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 1.9320 5.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 1.3030 5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2420 -0.1860 5.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -0.6740 5.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3300 -0.9750 5.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 3.3500 8.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 2.4750 9.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 2.8780 10.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 4.1510 10.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 5.0240 9.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 4.6290 8.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 4.6540 12.4430 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 2.2580 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 2.1340 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 3.8760 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.3130 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 3.5030 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 1.8810 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 3.0580 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 4.4900 3.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0590 1.7080 6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 1.5070 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1960 -0.5850 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2470 -1.9330 5.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 1.4810 8.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 2.1970 11.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 6.0180 10.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 5.3120 8.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 1.2510 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 2.5560 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 3.1950 0.8410 N 0 0 0 0 0 0 0 0 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 1 44 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 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END