PUBCHEM-ZINC06257055 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 1.0100 -2.9810 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -2.3160 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -3.1110 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -2.5680 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.2300 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.4270 -0.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -0.9520 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 0.0670 -2.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1750 1.0540 -2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 0.1670 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -0.3450 -4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -0.2420 -5.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 0.3710 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 0.8840 -3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 0.7840 -2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 1.2680 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 1.7610 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 1.0880 -4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 1.1820 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 0.0190 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -0.2180 -2.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3490 -1.2510 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 0.7210 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 1.9260 -1.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 2.4060 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.6960 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -2.7350 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -4.0720 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -4.1700 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -3.1770 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -0.7500 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -0.8480 -5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -0.6450 -6.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 0.4510 -5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 1.3600 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 0.9920 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 2.6660 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 2.0290 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 0.8270 -5.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 2.0100 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 2.1370 -3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 1.1500 -5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 0.2420 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -0.8680 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -0.0450 -3.3190 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.9060 -3.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 0.4750 -0.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 45 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 23 47 2 0 0 0 0 24 25 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END