IBS-ZINC04813188 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.9310 -0.3200 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0250 0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.6520 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -0.4090 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -1.0420 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9330 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -2.1750 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -1.5320 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 -2.6140 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 -3.9540 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -1.8820 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2370 -0.4840 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6770 -0.1430 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1240 0.9850 0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4120 -1.2660 0.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 -2.4250 0.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7750 -3.0190 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6350 -3.2680 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -4.6460 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -5.4200 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8410 -4.8150 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 -3.4350 3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7930 -2.6630 2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9430 -5.5710 4.9280 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.7930 -1.3190 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4790 -0.1880 0.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7950 -0.2030 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4540 -1.4210 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7050 -2.5840 0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 -2.4980 0.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 0.3120 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 0.2460 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -1.3860 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -0.0450 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 0.2780 1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -0.8530 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -2.8610 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -1.7140 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4470 -5.1180 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6310 -6.4970 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 -2.9620 4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8350 -1.5860 2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3490 0.7220 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5280 -1.4620 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1880 -3.5490 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -4.3100 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 31 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 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 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 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 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 M END