SIAL-ZINC04514079 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 1 0 0 0 0 0999 V2000 0.2610 1.9040 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.6450 -0.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -0.2810 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 0.1210 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 1.4420 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 2.3940 0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 1.5640 0.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 0.3440 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -0.5540 -0.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -0.1230 -0.1020 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 2.7860 0.6330 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6820 3.3460 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 3.6810 -0.4530 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2280 4.3240 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 4.4630 0.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7600 5.5000 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 3.7240 1.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7530 4.2930 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 2.4910 1.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6790 3.3830 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 4.4130 2.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 5.9310 2.1730 P 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 6.4890 2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 4.4540 -0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9130 5.0570 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 2.9420 -1.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 3.3610 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -1.5700 -0.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 2.6100 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 2.5130 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 3.0740 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -1.7880 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.2640 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5340 6.5910 2.9070 O 0 5 0 0 0 0 0 0 0 0 0 0 8.6060 5.7020 0.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 28 32 1 0 0 0 0 28 33 1 0 0 0 0 M CHG 1 34 -1 M CHG 1 35 -1 M END