PUBCHEM-ZINC03735370 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 0.5860 1.5730 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 0.1130 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.5050 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -1.8680 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.6550 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -2.0370 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -0.6600 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -2.7960 -2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -4.1420 -0.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0620 -4.5850 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -4.4800 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -5.4970 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -5.4760 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -6.2270 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3890 -5.9190 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4850 -4.9010 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 -4.1360 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -4.4490 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -3.8620 -1.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -3.0860 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8080 -4.5870 -2.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -7.3500 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -6.3820 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -6.3080 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 1.7050 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 2.0170 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 2.1220 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 0.0730 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -2.3060 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -0.1790 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -3.1750 -2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -2.1600 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 -3.6280 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2830 -6.4920 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 -3.3270 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3570 -3.8660 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6710 -4.1660 -3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -5.4930 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 -7.0650 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 -7.6010 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 -8.2430 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -6.0630 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -7.4220 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -6.7420 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -6.8170 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -4.8760 0.7520 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0740 -4.8240 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -4.3650 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 46 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 46 1 M END