IBS-ZINC04302351 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3900 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 1.1780 -0.6890 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0140 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.1050 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.1140 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 1.4570 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 1.8850 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 0.7190 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0170 -0.3620 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 0.0370 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -0.6390 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4670 -1.7560 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3210 -2.0260 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -3.4820 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6230 -3.7400 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 -3.4700 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 -2.0140 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 0.6680 -0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 3.2160 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7850 3.7820 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 3.8550 -1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 5.1960 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4610 5.7520 -2.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5320 5.6530 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 7.2350 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2340 7.2850 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1850 5.9960 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 5.0420 -3.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9090 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5490 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 3.1840 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -2.4180 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -1.3640 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 -1.8430 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4000 -3.6740 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -4.1440 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4900 -3.0780 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9580 -4.7770 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3620 -3.6530 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9030 -4.1310 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 -1.8220 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1650 -1.3520 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 1.4900 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6660 -0.1890 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 5.8140 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 5.2050 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1410 7.8610 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 7.5490 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3020 8.1710 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0630 7.2500 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 6.1620 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1920 5.6560 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END