PUBCHEM-ZINC05605621 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.2810 0.8290 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -0.4230 -1.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -1.2130 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -0.6390 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.3260 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 1.6530 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 2.5510 -0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 1.8280 -1.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -0.1690 0.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -1.4190 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -1.7610 0.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -3.0560 0.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3780 -3.0690 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -3.5770 -0.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4410 -4.4940 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -4.0520 -1.7590 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5780 -3.2170 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.6990 -0.8330 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1500 -4.4860 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -4.0600 0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -6.2130 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -6.7240 0.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 -7.9980 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -8.8330 -0.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -8.2930 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -9.4810 2.6120 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -4.9340 -2.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -4.5110 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -2.6970 -1.3730 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5450 0.9430 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -2.1260 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -6.4560 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -6.7410 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -6.0820 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -8.8050 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 -7.3970 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 2 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 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 35 1 0 0 0 0 25 36 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 29 -1 M END