CHEMDIV-ZINC00227105 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -2.6660 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0240 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -3.0350 -0.0310 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -2.6290 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7820 -1.8880 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 -3.4980 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -4.1030 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2910 -3.8620 -0.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8310 -4.9110 -2.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -3.4980 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -3.5430 2.0480 O 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 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -3.7450 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -2.8840 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -4.2930 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 -5.1030 -2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7190 -5.3000 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 -4.2220 1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -4.7640 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 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 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 28 29 1 0 0 0 0 M END