CHEMSTAR-ZINC04554844 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -3.0790 -2.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -2.2190 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -0.9890 -4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -0.3220 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 -0.8680 -5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -2.0910 -4.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -2.7710 -3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -4.0600 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -4.8510 -3.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.1820 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -5.1050 -1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 0.0610 -6.2820 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.5510 -4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 0.6340 -5.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -2.5180 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 M END