CHEMDIV-ZINC03188174 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 0.9000 0.8470 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.6280 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -1.1080 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -0.8050 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -2.2570 -0.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1810 -2.8130 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -2.1300 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 -2.3240 -1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -2.9870 -1.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.7150 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -3.8600 -0.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -4.3370 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -5.0410 -2.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -5.6520 -4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -6.3280 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -6.9980 -5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -6.9890 -6.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -6.3190 -6.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -5.6500 -5.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -7.8920 -8.0470 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 0.9890 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 1.2040 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 1.4780 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -1.1930 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -2.1810 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.9250 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -0.5840 2.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -0.2310 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.3330 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -2.9310 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -5.0200 -2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -3.5210 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -6.3320 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -7.5170 -5.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -6.3110 -7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -5.1400 -5.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -1.8650 1.0600 O 0 5 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 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 M CHG 1 37 -1 M END