PUBCHEM-ZINC05487520 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.5280 1.3270 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -0.1950 0.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1220 -0.5620 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.7590 1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.2580 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -3.0070 2.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -2.7900 1.2270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0310 -1.9940 -0.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1020 -2.1530 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -0.5780 0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -2.4340 -1.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -3.8520 -1.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5910 -4.0610 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -4.2990 -2.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2830 -4.0540 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -5.8500 -2.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9380 -6.1460 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -6.6660 -1.6350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1790 -7.6590 -1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -6.0860 -0.3060 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9070 -6.4650 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -4.5520 -0.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1540 -4.2060 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -4.1960 1.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -7.9020 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -6.6220 -1.5960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5290 -7.3690 -4.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -3.8040 -3.7920 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.5510 2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 1.6880 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 1.7250 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 1.7400 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -0.5110 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.3760 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -8.2060 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -8.6480 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -7.7390 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -8.2500 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -7.4750 -5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -7.2070 -5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -3.0970 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -6.6260 0.7610 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8870 -6.7510 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -5.8980 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -6.1930 -4.0300 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8710 -5.3090 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -6.2850 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 28 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 42 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 45 1 0 0 0 0 29 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 26 -1 M CHG 1 28 -1 M CHG 1 42 1 M CHG 1 45 1 M END