IBS-ZINC04909710 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0070 1.6710 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 1.6460 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 1.6860 -2.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 1.6640 -3.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 1.7030 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 1.7570 -4.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 1.6790 -6.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 1.6160 -6.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 1.5950 -7.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 1.6350 -8.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 1.6970 -8.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 1.7250 -7.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 1.7920 -7.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 1.6130 -9.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 1.5860 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 1.3750 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 1.1200 0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 1.4560 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 1.1070 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 0.2860 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -0.0690 3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2470 0.3830 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 1.2230 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 1.5960 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 2.4400 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0480 2.8930 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7370 2.5320 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 1.7050 2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.6510 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 2.1310 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 2.2470 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 1.6200 -3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 1.5840 -5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 1.5460 -7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 1.7280 -9.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 0.9290 -7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 2.4890 -9.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 1.6980 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.7300 -2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6260 1.7580 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -0.0880 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -0.7140 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7720 0.0960 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 2.7280 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5220 3.5420 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7370 2.9050 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7180 1.4330 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 15 2 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 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 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END