IBS-ZINC02209061 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -0.9760 2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -0.4210 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 0.0860 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 -0.0060 0.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 0.2870 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -0.5750 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -0.8550 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -1.4330 3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -1.7260 4.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 -1.4460 4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -0.8820 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -0.0450 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -0.4710 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -1.9970 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -2.4610 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -1.9780 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -2.4250 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -3.9290 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -4.6460 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -6.0250 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3690 -6.6890 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -5.9720 -2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -4.5920 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 0.4940 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -1.6510 3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -2.1750 5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9420 -1.6790 4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3930 -0.6670 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -0.4810 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 1.0420 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -0.0240 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -0.1370 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -2.4440 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -2.0460 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -3.5500 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -2.2950 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -2.4050 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -2.0530 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -2.0130 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -4.1280 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -6.5850 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -7.7670 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -6.4900 -2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 -4.0320 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 M END