IBS-ZINC02235626 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.2430 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.0410 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.6590 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -0.0040 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 1.2700 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 1.9050 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 1.9180 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 3.0490 -0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 1.1760 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -0.0840 0.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -0.6590 0.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 1.7250 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 2.1840 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9490 2.6330 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 3.1900 2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 4.2800 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 3.8070 3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 3.3080 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 5.6190 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3190 5.7530 1.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 6.6590 3.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 7.9910 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 8.9000 3.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 10.2310 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 10.2010 1.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 1.7260 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -0.5620 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -1.6610 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 2.9080 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 0.9440 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 2.5620 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 1.3290 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5890 1.7850 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 3.3880 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 2.3620 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4390 3.5680 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 4.4670 4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 2.9900 4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3600 4.6020 3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 4.1440 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 2.9510 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 6.5020 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9690 8.3790 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 7.8910 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 8.4810 3.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 9.0300 4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 11.1960 3.2990 O 0 5 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 M CHG 1 47 -1 M END