IBS-ZINC05533214 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -1.9930 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -2.8800 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -4.1760 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -5.2950 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -5.0910 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -6.1780 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -5.9470 4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -4.6400 5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -3.5690 4.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -3.7650 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -2.7220 2.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -6.9970 5.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -6.6900 7.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -3.9830 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -2.6980 -1.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -4.9920 -2.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -4.6700 -3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -3.5030 -3.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -5.7370 -4.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -7.0780 -4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -8.0710 -4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -7.7430 -6.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 -6.4120 -6.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -5.4070 -5.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -6.0950 -8.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -7.1820 -8.9490 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.2920 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -7.1900 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -4.4810 6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.5680 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -6.0980 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -6.1230 7.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -7.6150 7.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -5.9230 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -7.3380 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -9.1090 -4.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -8.5250 -7.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -4.3720 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -6.7910 -9.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -7.7790 -8.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -7.8050 -8.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END