IBS-ZINC02301890 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1850 0.8020 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.5610 -0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -1.0040 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -0.1480 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.6090 3.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -1.9350 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -2.7820 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.3250 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -3.1660 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -4.5060 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -5.2860 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -5.3170 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -6.0300 -3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -6.7160 -3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -6.6890 -2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -5.9720 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -7.4210 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -7.3960 -1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 0.2960 4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -0.1540 5.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -1.4430 5.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -2.2900 5.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -1.6160 7.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.6450 8.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -0.6760 9.7150 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 0.6780 6.9210 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 1.4560 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 1.0250 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.9640 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 0.8740 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -2.2940 3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -3.8050 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -4.4930 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.9770 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -4.7820 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -6.0500 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -7.2720 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -5.9500 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 1.3200 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -2.4410 7.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -8.1160 -3.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -8.5780 -3.1950 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 19 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 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 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 26 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 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 41 42 1 0 0 0 0 M END