IBS-ZINC02411978 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 45 0 0 0 0 0 0 0 0999 V2000 -0.1270 1.0550 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 0.7580 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 0.2030 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -0.0580 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 0.2380 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 0.7930 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -0.6440 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -0.1050 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 -0.7270 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2940 -1.8940 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4130 -2.7750 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 -3.8310 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1450 -4.7660 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 -4.6070 0.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5140 -3.5650 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6210 -2.6250 -0.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8960 -6.1450 2.2390 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5320 -6.9450 2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 -8.1610 3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7810 -7.9670 4.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 -3.7250 1.4680 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -2.3210 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -1.7550 0.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0150 0.0160 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 1.3790 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 1.1120 -1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 1.4840 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 0.9520 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -0.0400 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 0.0320 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 1.0150 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4910 -3.4760 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7590 -7.2600 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3140 -6.2650 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0260 0.1020 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -0.4760 -2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 2.0110 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 1.9110 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 0.8830 -2.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 1.9670 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0720 -9.2390 2.5190 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 23 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 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 21 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M CHG 1 41 -1 M END