ANALYTICONDISCOVERY-ZINC04221782 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 0.4420 0.8380 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -0.6650 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -1.4370 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 -1.0690 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -0.4160 -1.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9420 0.6750 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -0.8380 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -0.2680 -2.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 0.3660 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -0.4710 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 -1.5420 -0.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -0.7540 -2.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 0.0340 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 1.0030 -3.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -0.4010 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 0.0940 -5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.2650 -7.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0560 -0.5910 -7.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -1.4110 -7.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2070 -2.3750 -7.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -1.3250 -5.7410 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1330 -0.4290 -5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -1.3260 -4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -2.4500 -5.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -2.5090 -6.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -1.4250 -8.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -0.7860 -8.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 0.9450 -7.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 1.7380 -8.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 1.4940 -9.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 2.9770 -9.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 2.5090 -9.8700 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 4.1570 -10.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 3.9690 -11.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 3.5870 -12.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 1.0810 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 1.4100 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 1.1840 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -0.9430 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -1.1970 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.5180 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -1.1960 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -2.1610 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -0.8270 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -1.6080 -2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 0.7820 -6.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -1.0500 -3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -2.3460 -4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 1.2260 -7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 3.5650 -9.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 3.5720 -8.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 4.5460 -11.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 4.8490 -9.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 4.2880 -10.5740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 28 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 34 35 2 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 54 -1 M END