PUBCHEM-ZINC03741415 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 1.9760 2.1150 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 0.7240 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -0.3210 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -1.7200 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -2.6260 -2.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -3.9370 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -4.7620 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -6.1280 -2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -6.6880 -2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -5.8610 -2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -4.4910 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -8.1220 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -9.1020 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -10.3500 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -11.6810 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -12.6970 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -12.4080 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -11.0980 -5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -10.0910 -4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -8.7410 -4.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -8.2700 -4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -10.7360 -6.7410 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -8.9030 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -8.7610 0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -8.4340 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -8.2530 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 2.4170 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 2.1510 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 2.8470 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 0.7310 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 0.4660 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -0.3250 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -0.0630 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -1.7290 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -1.9970 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -4.3360 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -6.7500 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -6.2760 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -3.8910 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0060 -11.9230 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -13.7210 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -13.2170 -5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -9.7450 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -8.0150 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -7.9680 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -9.6890 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 -9.2380 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -7.5170 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -7.4380 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -9.1730 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -7.8980 3.9950 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4610 -7.7800 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -7.0160 4.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -8.6270 4.3940 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 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 23 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 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 M CHG 1 51 1 M END