ANALYTICONDISCOVERY-ZINC04221826 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 -0.0800 1.5190 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 0.0020 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -0.5510 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.1290 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 1.6540 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 2.2050 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 -0.3760 2.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -0.4370 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -0.0620 1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -0.9690 3.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 -1.1860 3.5970 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9120 -0.3690 3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7150 -2.4860 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -3.6100 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0870 -3.6770 5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 -2.4970 5.7720 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3100 -2.6480 5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -1.1680 5.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8130 -0.9650 5.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -0.1360 5.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 0.6840 5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 -2.4380 7.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -1.5540 7.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3310 -4.8120 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -4.8420 1.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8480 -5.8810 3.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1840 -7.1470 2.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5610 -6.9310 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2450 -7.8790 3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5730 -7.1160 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4750 -7.3890 4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0120 -8.1550 5.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 -8.0370 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 -7.6630 3.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -6.8220 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -8.2320 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 -9.0710 1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.8890 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.7820 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.4600 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.2690 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -0.4120 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -1.6340 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -0.1170 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 1.9300 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 2.1290 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 2.0640 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.2840 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -0.6730 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -1.2250 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 -2.4740 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 -4.5920 5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 -3.7340 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0430 -5.8230 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8530 -8.0320 4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4230 -8.8820 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1350 -7.3410 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3990 -6.0330 3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5890 -6.7940 4.8080 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 2 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 33 34 1 0 0 0 0 33 37 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 59 -1 M END