CHEMDIV-ZINC04661017 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -2.0430 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.5250 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -2.0290 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4970 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -3.6060 -0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -3.4480 -1.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -3.4620 1.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -5.2210 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -5.8470 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -7.1140 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -7.7660 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -7.1380 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -5.8590 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -7.8250 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -8.9400 2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -7.2170 3.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -7.8990 4.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -6.9970 6.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -7.6980 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -8.4980 7.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -9.1420 9.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -8.9850 9.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -8.1840 9.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -7.5370 7.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -9.0040 -0.0780 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.1550 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -0.1400 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.4090 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -2.4000 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -2.3870 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.3850 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.1170 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -0.1410 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -5.3430 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -7.5970 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -5.3700 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -6.3280 3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -8.1180 4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -8.8290 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -6.7780 5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -6.0660 5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -8.6210 7.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -9.7670 9.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -9.4880 10.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -8.0620 9.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -6.9090 7.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M END