CHEMDIV-ZINC04598501 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 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 2.1880 -0.0920 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 0.5860 0.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 1.0200 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 1.9590 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3320 2.3940 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 1.9040 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 0.9620 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 0.5220 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -0.7030 1.8070 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -1.9700 1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 -0.3450 2.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -0.4520 2.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 0.5050 -2.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -0.4970 -1.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -0.1120 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -0.0610 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 0.7330 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 0.1530 -4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 0.5630 -5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 -0.5040 -5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -1.1320 -3.7900 C 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 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -1.5980 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 2.3440 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4950 3.1240 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 2.2560 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 0.5750 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -0.5560 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -1.0110 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7230 0.8680 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 -1.0760 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7970 0.3710 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 0.7710 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 1.7470 -3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -0.9340 -4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9030 0.5450 -5.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 0.7360 -6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 1.4920 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -1.2930 -5.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -0.0440 -5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -1.6280 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 -1.8760 -3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END