PUBCHEM-ZINC02506243 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -0.5550 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9520 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -2.6800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0300 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -2.7530 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 0.2250 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 -0.3840 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 0.3580 0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3790 -0.2750 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4210 -1.4910 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6300 0.5060 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5860 1.9020 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7590 2.6270 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9830 1.9750 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0400 0.5960 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8700 -0.1480 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9240 -1.5040 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2230 -2.1010 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0860 -3.6020 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8200 -4.3350 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6990 4.5170 0.1310 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.1780 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -2.4610 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -3.7600 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -2.9710 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8180 1.3050 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1560 1.3270 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6350 2.4140 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8970 2.5500 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9970 0.0950 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7610 -1.7950 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7740 -1.7770 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3830 -4.0720 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5230 -3.8640 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7220 -5.4100 0.8610 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 10 1 0 0 0 0 6 7 2 0 0 0 0 6 30 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 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 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 M END