PUBCHEM-ZINC03688156 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.4240 1.5870 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 0.1780 0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -0.4510 -1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 0.2120 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -0.5050 -3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -1.8880 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.5650 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -1.8540 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -2.6130 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.7880 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -3.7190 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -4.3160 2.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -5.2310 3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -5.5360 3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -4.9490 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -4.0550 1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -3.3650 0.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -3.4080 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -5.8660 3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2200 -6.3820 4.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -2.1600 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -2.9930 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -2.3390 -2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -3.1660 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 -2.8550 -4.7410 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 1.8560 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 2.1050 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.9100 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 1.2890 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 0.0300 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -3.6470 -2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -4.0760 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -6.2430 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -5.1920 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -2.0410 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -1.1490 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -3.1190 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -4.0000 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 -2.2330 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -1.3280 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -3.2480 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -4.1650 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -2.4970 -4.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9950 -3.0220 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -1.5460 -4.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5340 -2.4290 -3.6150 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 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 3 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 43 46 1 0 0 0 0 M CHG 1 43 1 M END