PUBCHEM-ZINC06026598 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -2.1860 2.2790 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 0.8430 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 -0.0110 0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -1.3680 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -1.9800 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -3.3800 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -4.1930 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -3.5640 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -2.1680 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 -1.4950 0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1820 -2.2530 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3450 -1.2790 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -5.7180 0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4380 -6.0690 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -5.4140 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -3.9770 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -6.4100 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -7.0320 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 -7.6430 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -7.6240 -2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -7.0050 -3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -6.4120 -2.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -7.1270 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 2.9790 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 2.4860 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 2.4610 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 0.6850 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 0.6580 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -1.3830 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -4.1770 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -2.8420 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 -2.9110 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2920 -0.6630 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 -0.5950 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3010 -1.8120 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -5.8880 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -5.4910 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -3.9330 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -3.3810 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -8.1450 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -8.0900 -3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -6.9710 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -6.1520 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -7.4850 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2340 -7.8290 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -6.1910 -0.2920 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8190 -7.1920 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -6.1340 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 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 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 46 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 46 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 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