IBS-ZINC04085562 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7960 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1310 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0740 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7840 -1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.2580 -1.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0500 -4.1780 -1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -3.1960 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -4.0330 -3.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -3.7470 -4.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1920 -2.8960 -5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -4.9820 -5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -5.3680 -6.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -6.6100 -7.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -7.4270 -6.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -7.0570 -5.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -5.8140 -5.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -5.1480 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -5.5470 -3.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -3.4340 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -3.2330 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -2.9700 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -2.6680 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -2.4790 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 -2.5810 -1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -2.8780 -3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -3.0740 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.3440 -4.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -3.4860 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.4750 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.0250 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -2.1670 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -3.5770 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -4.7330 -6.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 -6.9450 -7.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -8.3800 -7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -7.7000 -5.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -2.5880 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -2.2430 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -2.4230 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4030 -2.9550 -4.0000 H 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 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 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 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 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 M END