IBS-ZINC04702838 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.5480 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -4.0110 -0.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -4.6500 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.5280 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -6.0230 0.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -6.6780 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -8.0050 1.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -8.6850 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -7.9760 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -8.6250 4.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -7.8860 4.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -6.4940 4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -5.8360 3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -6.5640 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -5.9630 2.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -8.5120 5.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -7.6870 6.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -10.1860 2.5700 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -2.1520 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -2.2840 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -4.5120 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -2.2430 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.1030 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -6.5310 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -9.7000 4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -5.9310 5.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -4.7610 3.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6820 -7.1350 5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -6.9840 7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 -8.3110 7.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -10.6350 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -10.5110 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -10.4980 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0020 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -3.9830 1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 8 1 0 0 0 0 6 45 2 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 21 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 M END