PUBCHEM-ZINC06068174 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.5530 1.2770 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.1670 -0.4400 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.7320 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -0.8130 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -0.4010 -1.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8120 0.1430 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.0880 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -0.0270 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 -1.0550 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1870 -0.8050 -2.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -1.4020 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 0.4210 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 0.9590 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 2.2070 -2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 2.8990 -3.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 2.3700 -4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 1.1440 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0840 3.3480 -5.6290 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -1.8750 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -2.6840 -0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 1.7430 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 1.7130 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 1.4490 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -0.5910 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -1.7970 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.2270 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -0.3940 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -1.8850 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -0.6390 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 1.1290 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.5220 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 -1.9460 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 2.6230 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 3.8640 -4.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 0.7410 -4.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -2.2900 -2.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -3.2450 -2.7950 H 0 0 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 5 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 27 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 19 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 2 1 M END