IBS-ZINC02224755 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 -0.0630 1.4940 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.0360 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.5170 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -2.0460 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -2.4960 1.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -3.8380 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -4.3420 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -5.7020 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -6.5760 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -6.0650 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -4.7040 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -8.0340 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 -8.4770 3.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -8.8750 1.8690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -10.2070 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 -10.8310 3.2100 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -11.0490 1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -12.4310 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -13.2920 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -14.6570 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -15.1760 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -14.3180 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -12.9390 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -14.8680 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -16.0680 1.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -16.8920 1.6870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 1.8440 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 1.8370 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 1.8890 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -0.3860 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -0.4310 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -0.1670 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.1220 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -2.3970 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.4420 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -3.6660 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -6.0930 3.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -6.7370 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -4.3080 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -8.5220 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -10.6970 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -12.8930 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -15.3210 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -12.2710 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 -14.0390 1.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -14.4450 1.6730 H 0 0 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 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 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 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 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 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 M END