PUBCHEM-ZINC04538057 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.3290 1.7210 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 0.1970 -0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8340 -0.0980 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -0.4570 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.9960 1.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4170 -2.3160 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.4710 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -1.8280 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.3040 -0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8360 0.0630 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.5760 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -4.1160 2.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4830 -4.5010 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -4.5170 3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -6.0320 3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -6.6850 2.8020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9950 -7.7750 2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -6.2830 1.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3760 -6.6990 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -4.7570 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -6.8820 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 2.0380 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 2.2170 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 2.0870 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -0.1380 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.0990 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -3.5580 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -2.2330 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -2.1900 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -2.1570 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -2.1850 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.1890 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -4.0530 3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -4.1290 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -6.2660 4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -6.4630 4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -4.5500 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -4.3000 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 -7.9650 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -6.7010 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -6.4430 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 0.2390 -1.5210 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7260 -0.1460 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 0.0220 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 1.2610 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -6.2960 2.8690 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0140 -6.8220 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 -6.5010 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 -5.2960 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 42 1 M CHG 1 46 1 M END