IFLAB-ZINC04854042 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.0250 -0.7040 1.2480 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 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 0.0160 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -0.5990 -3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -2.4580 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.8440 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8500 -3.4970 -4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -2.6080 -5.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.4110 -5.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -3.1530 -6.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -2.2010 -7.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -1.8630 -6.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -0.8780 -6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -0.4760 -5.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -1.6880 -4.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 -2.1220 -4.4910 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -0.9320 -4.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 -2.9380 -3.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -3.1600 -5.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 -2.7380 -6.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 -3.7390 -7.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 -4.9740 -7.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -4.9120 -5.8400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -1.6650 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -0.8670 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -0.1140 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 0.9810 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -0.1140 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -3.4240 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -2.3290 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -4.1230 -4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -3.6300 -7.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -1.7800 -8.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -1.3150 -7.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 0.0030 -7.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 0.0560 -5.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 0.1690 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 -1.6950 -7.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 -3.5360 -8.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5940 -5.8740 -7.9740 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END