CHEMBRIDGE-ZINC01123117 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.0690 1.2240 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0110 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.5590 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.8320 1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -2.3020 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -1.5260 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -0.3400 1.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 0.1780 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 1.4550 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 1.9580 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 2.2020 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 3.5460 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 4.1130 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 4.3440 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 6.1060 -0.3450 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 6.7810 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 8.1280 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5590 8.7150 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 8.9310 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5400 9.5300 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 10.8700 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 10.6540 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 10.0560 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4580 7.7550 -1.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4980 8.0660 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2970 6.3590 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 5.6070 -0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 5.9410 -0.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0780 7.7750 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 7.7910 -3.9940 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 8.9890 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 9.6720 -0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 1.6370 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5680 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -2.4210 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -3.2750 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 -1.9100 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 2.9350 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 1.7550 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 4.1660 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 4.0380 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 9.6130 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1910 7.9750 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9510 9.6830 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1830 8.8470 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 11.5530 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4650 11.2970 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8360 11.6090 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5310 9.9710 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 9.9020 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8430 10.7390 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 5.0390 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 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 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 52 1 0 0 0 0 29 30 3 0 0 0 0 31 32 3 0 0 0 0 M END