PUBCHEM-ZINC03871105 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0290 1.6880 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.3740 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -0.5030 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -1.7250 -0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 0.1250 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -0.4630 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4820 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 1.9180 0.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 2.2580 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 3.7090 0.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2490 4.0400 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 4.1370 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 5.5360 1.6040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4880 5.9090 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 5.4090 0.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3820 6.3310 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 4.3980 -0.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 4.9460 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 4.9380 0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 6.0960 0.3380 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 7.3970 0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 6.4190 1.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 6.5010 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -0.3820 -0.5520 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 2.3670 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 3.4990 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 4.0860 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 3.9240 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 5.5920 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 5.9100 -0.8970 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.4550 5.7610 1.6540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 31 -1 M END