IFLAB-ZINC04188946 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 -0.4290 2.1230 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 1.8260 0.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 1.1360 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 0.8140 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 0.1140 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -0.2680 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 0.0540 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 0.7590 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 -0.9790 -0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -1.2800 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 -1.9850 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2000 -2.9140 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8450 -2.2090 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7460 -3.9610 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 -4.6710 -2.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6970 -3.9340 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0940 -5.4370 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1750 -6.0040 -3.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3730 -6.7450 -4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3520 -7.3020 -5.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2900 -8.2510 -5.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1310 -8.8440 -6.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9810 -8.5200 -7.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8200 -9.1230 -9.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8140 -10.0500 -9.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9620 -10.3780 -8.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 -9.7700 -6.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9730 -11.2900 -8.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 -11.8730 -9.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6830 -5.5860 -2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 2.6740 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 1.1930 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 2.7270 -1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 1.1120 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -0.1370 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -0.2430 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 1.0130 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1910 -0.3520 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -1.9290 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2990 -1.3250 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7190 -2.2350 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -3.8420 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9790 -2.2650 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -2.8690 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 -1.9590 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5860 -3.2700 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8170 -4.7000 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1350 -6.2330 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9300 -4.7550 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4400 -7.5680 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2360 -6.0890 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3020 -7.7910 -5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1960 -6.4880 -6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7690 -7.7960 -7.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4830 -8.8700 -9.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6900 -10.5200 -10.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4530 -10.0200 -6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7950 -12.3920 -9.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6880 -11.0890 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0400 -12.5820 -9.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 -6.2720 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4870 -3.2160 -0.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 62 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 62 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 M END