IBS-ZINC04295487 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 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 -0.6960 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0560 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7750 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1780 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.8200 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -6.2280 -1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -6.2570 -2.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -4.9580 -3.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.0580 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7380 -2.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0740 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6660 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -4.6120 -4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -7.3370 -0.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -8.5820 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -8.7410 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -9.7770 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -11.0600 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -12.2690 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -11.1730 -1.9730 C 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 0.0250 -0.1440 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.5800 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -4.7400 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1130 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -4.5390 -5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -3.6540 -5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -5.3840 -5.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -7.2100 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -9.7400 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -9.7640 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -11.0320 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -12.2970 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -13.1830 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -12.1880 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -11.2010 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -10.3120 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -12.0870 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 14 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 13 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END