PUBCHEM-ZINC03752459 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.8980 1.3880 -1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 0.1560 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -0.9570 -2.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.0530 -1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.9270 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -4.0710 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -4.3440 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -3.4830 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.3200 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -1.4300 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -0.8960 -3.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -0.0830 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 0.6930 -4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 1.3950 -6.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 1.3340 -6.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 0.5720 -6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -0.1260 -4.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -0.9390 -4.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -1.1520 -4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 0.5460 -6.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -1.0600 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -1.9360 -2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 -3.1840 -2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -5.9060 -0.1810 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 1.5770 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 1.2440 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 2.2690 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 0.3230 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -0.0260 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.7130 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -4.7440 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -3.7260 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 0.7350 -4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 1.9880 -6.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 1.8930 -7.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 0.1510 -7.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.0820 -6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 1.5590 -6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -0.0730 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -1.4920 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6570 -1.3060 -3.1010 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 41 -1 M END