PUBCHEM-ZINC05738072 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 2.4290 0.5320 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -0.7020 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -1.6050 1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -2.7740 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -3.0410 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -2.1600 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -0.9940 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -2.5190 -2.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.8470 -3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -2.5890 -4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -4.0040 -4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -4.6390 -6.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -3.8780 -7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -2.4870 -7.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -1.8320 -5.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -0.4960 -5.8410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.1190 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -0.4970 -3.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 1.6180 -4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 2.0970 -5.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 4.0230 -5.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 5.5270 -5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 6.2460 -6.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 5.9080 -5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 4.4230 -5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -4.1960 -0.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 0.3210 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 1.3470 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 0.8850 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -1.4030 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -3.4610 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.3010 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -3.4220 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -4.6300 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -5.7230 -6.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -4.3620 -8.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -1.8980 -7.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.9960 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 1.9750 -5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 1.8800 -6.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 1.6280 -4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 3.4650 -4.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 3.7500 -6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 5.8500 -5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 5.7960 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 6.5080 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 6.1880 -4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 4.1500 -6.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 4.1600 -5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -4.7020 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 3.5970 -5.1130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8540 3.8100 -4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 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 48 1 0 0 0 0 25 49 1 0 0 0 0 25 51 1 0 0 0 0 26 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END