IFLAB-ZINC04496626 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 1.6810 5.3350 1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 6.0230 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 5.5930 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 4.4670 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 3.7780 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 4.2140 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 3.9150 1.7660 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 2.4530 0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 1.8560 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 2.3660 1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 0.7550 -0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 0.2660 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1420 -1.1040 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4250 -1.5940 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5100 -0.7140 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2870 0.6650 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9940 1.1480 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3380 1.5260 -0.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8860 -1.2360 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1950 -2.4860 -0.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4970 -2.8060 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0870 -4.0840 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4390 -4.2160 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2650 -3.1020 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7190 -1.8430 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3370 -1.6870 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3370 -0.2440 -0.5160 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 5.6710 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 6.8980 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 6.1310 2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 2.9030 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 3.6790 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 1.7170 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 2.7430 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 0.3020 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 -1.7860 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5920 -2.6580 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8190 2.2100 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5930 1.8360 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4600 -4.9630 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8740 -5.2000 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3360 -3.2210 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3620 -0.9760 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 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 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 M END