PUBCHEM-ZINC05224583 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.4420 1.4490 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 0.2420 0.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -0.7090 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.8450 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.9950 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -2.9820 1.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -1.0340 0.9120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -1.1330 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0570 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 0.9000 -0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.6040 2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -1.9290 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -0.8110 1.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -2.5070 2.7190 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.8970 2.9540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1030 -4.6920 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -4.1240 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -5.1480 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -5.3560 4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -4.5410 5.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -3.5180 5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -3.3120 5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -3.9000 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -2.8660 4.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -5.1600 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -5.1680 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -6.3520 4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -7.5310 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -7.5320 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -6.3570 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 2.2310 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.7900 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.2230 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -5.7840 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -6.1550 4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 -4.7030 6.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -2.8810 6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -2.5150 5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -4.2480 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 -6.3600 5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -8.4560 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -8.4560 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -6.3600 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 29 30 1 0 0 0 0 29 42 1 0 0 0 0 30 43 1 0 0 0 0 M END