PUBCHEM-ZINC03871275 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.5980 1.9260 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 0.4180 0.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5930 0.1710 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -0.1650 0.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3680 0.5620 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -1.3490 0.9990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2380 -2.2480 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -1.5700 1.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9870 -2.1370 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.2580 2.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -2.2280 3.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -3.5700 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -3.7610 4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -5.0900 5.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -5.4020 6.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -6.0060 4.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -5.6990 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.4940 2.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -6.9550 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -6.7320 2.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -2.6000 5.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -1.7010 4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 0.0560 4.7140 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -0.9890 1.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -0.1340 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.5990 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 0.2970 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 2.6240 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 2.8630 -1.3800 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 3.6130 -1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 2.2910 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 2.1810 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -7.6820 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -6.5310 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 3.6670 -2.1450 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4050 1.4440 -1.9120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 35 1 0 0 0 0 29 36 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END