IBS-ZINC04088719 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1430 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4740 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.8660 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.6320 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -2.0030 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -3.9880 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -4.7050 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -2.5320 4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5970 5.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -3.2240 6.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -3.4900 7.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -4.1220 8.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -4.4960 8.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -4.2180 7.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -3.5700 6.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -3.2480 5.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -3.1540 4.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 -3.5670 3.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -5.1380 9.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -6.6550 9.5320 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 -7.0930 10.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -6.8920 9.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -7.1390 8.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2210 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.1200 3.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.5920 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -4.4290 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -5.7760 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -4.4550 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -2.1820 5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -3.1930 7.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -4.3340 9.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -4.5060 7.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -6.8140 8.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 -8.2220 8.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -6.6700 7.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 36 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END