PUBCHEM-ZINC05902169 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6900 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0800 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7570 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9730 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0030 -1.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6620 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0200 -2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6580 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.5010 2.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0530 -1.4640 3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3230 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.5850 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.8990 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -4.4050 2.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9780 -4.2480 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -5.8980 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -6.3820 3.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -7.7230 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -8.1840 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -9.5110 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -10.3810 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -9.9250 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -8.5980 3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -12.1970 4.4980 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -3.6880 3.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -2.8340 -2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -2.0170 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.6090 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -1.5020 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -3.9740 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -4.5040 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -6.0550 4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -6.4440 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -5.7710 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 -7.5050 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -9.8690 3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -10.6070 4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -8.2420 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -3.7830 4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 10 1 0 0 0 0 8 9 2 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 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 27 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 27 44 1 0 0 0 0 M CHG 1 11 1 M END