PUBCHEM-ZINC03738365 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.0330 1.6800 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 0.2330 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -0.4620 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -1.9160 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -2.4820 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -3.7880 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 -4.6310 0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -5.9500 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -6.4330 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2140 -5.5980 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -4.2760 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6370 -6.1000 0.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3120 -5.2600 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 -6.8070 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 -7.9750 1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1970 -8.2900 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 -9.3370 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0090 -9.3300 5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4460 -8.3120 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -7.2640 5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 -7.2790 3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -6.3860 3.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -5.5510 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9470 -10.7320 5.9990 Br 0 0 0 0 0 0 0 0 0 0 0 0 -7.2350 -8.6960 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 -7.7660 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 2.1580 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 1.7440 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 2.2480 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.2990 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 0.2030 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 0.0710 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 -0.4270 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -2.4630 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.9520 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -4.2960 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -6.6030 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -7.4650 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -3.5980 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3390 -10.1350 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5430 -8.3200 6.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 -6.4700 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5630 -9.5560 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2600 -9.0800 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 -8.3350 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8740 -7.0100 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -7.0190 -0.6520 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6320 -6.4660 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -7.6960 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 47 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 47 1 M END