IBS-ZINC02290727 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 65 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 2.3480 -1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 3.0990 -1.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 2.5370 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 3.5190 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9370 4.8080 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 4.4720 -1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 5.4360 -1.6720 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 6.7100 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 7.7470 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 9.0390 -1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 9.3560 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7980 8.3820 -1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 7.0330 -1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 6.0660 -1.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0830 3.3130 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7230 3.1540 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7080 3.2990 -0.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1570 3.0920 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6100 3.1200 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5010 2.6960 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0080 2.4260 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6910 3.5190 2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2880 3.7570 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7840 4.0420 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 1.1920 -1.2840 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.6290 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 3.1700 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 1.6470 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 1.3640 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 2.8870 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 7.5170 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 9.8300 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 10.3890 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8460 8.6420 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 3.4260 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4060 2.1260 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6630 3.8840 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3600 4.0860 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1040 2.3280 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9730 1.8400 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2840 3.5840 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3480 2.3220 3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2190 1.5080 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8310 4.6160 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5070 2.8780 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5720 4.9520 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4630 4.1680 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1560 0.5660 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 0.8660 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0630 2.9120 1.4340 N 0 0 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 61 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 M END