IBS-ZINC02148295 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.1940 -1.2260 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.7110 1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.6820 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6450 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -3.5420 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.4000 -1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -3.4730 -0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -2.5400 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -1.6100 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -0.6380 1.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -0.5920 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -1.5070 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -2.4820 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 -1.4490 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0300 -1.0520 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 -0.6720 -0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5350 -1.0800 0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9520 -0.4350 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0300 -2.5130 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 -2.5240 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9620 -0.6030 -1.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4250 0.9740 -1.4810 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8320 1.1040 -2.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4030 1.7690 -0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8690 1.2210 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1220 1.0890 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2540 1.2830 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1350 1.6100 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8820 1.7430 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7500 1.5540 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3700 1.8210 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -1.3210 3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -0.5230 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -2.1990 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -0.6160 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 0.2620 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -2.7240 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 0.0740 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 0.1580 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 -3.1880 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6450 -2.8960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 -3.1420 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9440 -2.0630 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9110 -1.9650 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9140 -3.5530 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9740 -1.2120 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2150 0.8330 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2330 1.1790 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7890 1.9990 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7710 1.6610 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6630 2.8700 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1600 1.5440 2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1800 1.2010 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END