ANALYTICONDISCOVERY-ZINC05433963 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 68 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 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 0.6050 -0.6070 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8360 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -2.6110 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0020 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.8290 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -4.2250 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -4.9550 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -4.3170 1.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -2.9930 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -2.2550 0.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -2.3650 3.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -3.1630 4.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6780 -4.0850 3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -3.4750 5.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -3.4140 6.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -2.2850 6.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3270 -1.3390 6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -2.3500 4.8460 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4980 -1.3650 4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5420 -3.1420 4.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 -2.7210 6.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -2.5410 7.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9400 -3.4490 7.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -1.3930 8.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 -1.6310 9.5720 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 -0.3450 10.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0440 -2.5150 9.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -2.5050 10.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -1.7920 11.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -2.4360 11.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -3.8400 11.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -4.5400 12.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -5.9010 12.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -6.6140 11.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -5.9700 11.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -4.5650 11.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 -3.8650 10.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.1450 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.3090 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.6880 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -4.7210 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -6.0350 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -1.3960 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -4.4720 5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -2.7280 5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -1.7740 5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 -3.4850 6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1450 -0.4940 7.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -0.7120 11.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -1.8700 12.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.0010 13.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -6.4370 13.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -7.6940 11.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4670 -6.5360 10.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -4.4050 9.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 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 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 51 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 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 33 1 0 0 0 0 32 41 2 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 59 1 0 0 0 0 37 38 1 0 0 0 0 37 60 1 0 0 0 0 38 39 2 0 0 0 0 38 61 1 0 0 0 0 39 40 1 0 0 0 0 39 62 1 0 0 0 0 40 41 1 0 0 0 0 41 63 1 0 0 0 0 M END