PUBCHEM-ZINC00479262 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 -0.0060 1.3910 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 0.4900 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 0.3200 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -0.5090 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -1.1680 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -1.0000 -1.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.1660 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.0100 -2.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7340 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.1200 -4.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.8850 -5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -2.0880 -5.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.2260 -7.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.9800 -8.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -0.3600 -9.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 1.0070 -9.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 1.7600 -8.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 1.1520 -7.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 1.8480 -11.3930 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.2380 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -0.6750 1.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 0.8110 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 1.8250 -0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 2.1880 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 0.8330 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 -1.8140 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -1.5150 -2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 0.6600 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 0.9560 -4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -2.0460 -8.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -0.9430 -10.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 2.8260 -8.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 1.7410 -6.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.5460 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -2.6400 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -2.6170 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0360 -0.0380 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 M END