IBS-ZINC06624567 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 0.1450 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -0.4630 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -1.8460 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.6390 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -2.0070 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.7470 0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -3.0870 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.1070 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -4.7810 1.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7100 3.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -6.0480 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -7.2310 2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -8.4470 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -8.5040 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -7.3370 5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -6.1030 4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -4.7110 5.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -3.9360 4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.5490 4.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 -1.9420 5.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -2.6380 6.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -4.0250 6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -9.7090 5.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -10.8740 4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -12.1060 5.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -11.9980 6.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 1.2230 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1370 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -3.6680 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -3.6770 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 -2.1750 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -7.1980 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -9.3620 3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -7.3830 6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -2.1040 7.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -4.5600 7.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -10.8730 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -10.8720 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -13.3240 4.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -14.0850 5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 45 46 1 0 0 0 0 M END