PUBCHEM-ZINC05010600 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.4970 1.8490 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.3540 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -0.4170 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 0.1370 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 0.1770 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -0.3010 2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 -1.7880 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 -2.6610 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 -2.4650 4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -3.5720 4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -4.8620 4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -5.0820 3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -3.9650 3.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -3.8760 2.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -2.5550 2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -2.0080 1.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3920 -2.1790 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -2.5500 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -1.9440 0.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9140 -2.2500 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.5810 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.4690 2.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -3.3000 -0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -3.9390 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -5.0250 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 2.1630 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 2.3540 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 2.1980 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.1180 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 1.2140 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -0.0760 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -0.0820 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 1.2610 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 0.1260 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2180 0.0570 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 -1.4620 4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5220 -3.4240 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 -5.7130 5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -6.0940 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -2.3460 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -3.6400 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 -3.1950 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -4.6640 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -4.4730 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -5.7970 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -4.7320 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -5.3960 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -0.4870 1.4230 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6300 -0.3300 2.3550 H 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 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 48 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END