PUBCHEM-ZINC03739626 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.1230 1.1520 0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.3230 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -1.2040 1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -2.5860 1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -3.0610 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.2210 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -0.8300 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -3.0470 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -4.3640 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -4.3470 -0.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -5.1680 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -5.6170 -2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -6.4060 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -7.5990 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -8.0220 -4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -7.2430 -4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -6.0370 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -5.2100 -3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -5.6390 -4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -8.6450 -3.2370 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5760 -3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -2.6550 -4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -2.2000 -5.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -2.3350 -5.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.4110 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 1.7260 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 1.4550 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -0.8180 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -3.2600 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -0.1540 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -6.0790 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -8.9550 -4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -7.6080 -4.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -4.8800 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -5.7160 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -6.5830 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -3.1760 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.5440 -3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -2.0340 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -3.6850 -4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 -2.8020 -6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -1.1570 -5.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -1.7100 -5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -3.3740 -5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -1.8800 -7.3900 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6000 -1.9810 -7.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -0.8880 -7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -2.4240 -8.0370 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 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 31 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 45 1 M END