IBS-ZINC01898133 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.3690 1.2830 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -0.2450 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -0.7220 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.1490 1.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -2.7370 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -4.1190 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -4.7150 3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -3.9350 4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -2.5580 4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -1.9570 3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -4.5870 5.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2440 -5.6660 5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -4.0400 6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -4.2700 7.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -3.5780 8.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -2.8900 8.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -2.3050 9.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -3.1880 7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -2.7670 7.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -3.4210 6.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 -4.2800 5.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7180 -4.9210 4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 -5.4300 3.8960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7770 -3.2020 6.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -5.1380 6.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -6.3770 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -7.1820 5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -6.7640 5.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -5.5320 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -4.7200 6.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -5.1240 6.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -6.0140 5.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 1.6180 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 1.6220 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 1.6970 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.5810 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -0.6590 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -0.3860 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.3080 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -4.7290 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -5.7910 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -1.9500 5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -0.8810 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -2.5910 7.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3080 -3.6570 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -6.7060 6.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -8.1420 5.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -7.3980 5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -3.7630 7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -6.9590 6.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 -5.5690 5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -6.1950 4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 3 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END