IFLAB-ZINC04139858 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8210 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5640 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -2.3790 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -2.6740 2.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -3.1720 3.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -3.2230 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -2.7260 3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.6540 4.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -3.0710 5.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -3.5600 6.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -3.6430 5.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -3.0020 6.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -3.4500 7.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -3.2980 7.8760 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1400 -3.8230 7.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -3.8910 9.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -4.4170 10.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8860 -4.3600 11.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5950 -5.2120 10.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -1.9120 7.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -3.5970 4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 -2.4290 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -2.1880 6.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -1.1170 6.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4620 -0.2860 6.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5940 -0.5270 4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 -1.6010 4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8490 -2.4750 1.4810 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 -1.0200 -0.3810 0.0100 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 -1.1870 -2.2730 3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -3.8840 7.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -4.0230 6.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -4.4980 7.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.8520 8.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -4.9230 9.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -3.3090 10.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -3.8380 11.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -5.4530 10.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0540 -4.6950 12.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2430 -3.3360 11.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5520 -5.2250 10.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -1.3810 8.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -4.3970 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 -3.9580 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -2.8380 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5730 -0.9290 7.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 0.5520 6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2070 0.1230 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -1.7910 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -1.4770 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -3.2200 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -2.5850 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 -3.8540 9.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 -2.9140 9.5400 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 60 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 60 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 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 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 60 61 1 0 0 0 0 M END