SIAL-ZINC04517241 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.4170 1.3650 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 0.0180 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -0.6350 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 0.0610 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 1.4360 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 2.0520 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 3.9150 -1.8600 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 2.2440 -2.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 1.9870 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 2.6790 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 2.0690 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 2.6600 0.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8590 5.8440 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2240 3.9040 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 4.5020 0.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5760 5.6990 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0960 6.3810 -0.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1610 5.8750 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 6.5210 -2.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 4.5180 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 3.9370 -2.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4950 6.3350 1.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -1.0250 -1.2960 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.7070 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -0.3960 -0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -1.6820 0.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -2.6670 1.0870 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2690 -2.2190 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.9500 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -3.7400 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6630 -5.0030 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -5.9910 -1.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -3.0950 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -2.8350 2.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 1.8720 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -1.7030 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 3.2380 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 0.9430 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 2.4290 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 1.0740 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8390 7.2650 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4290 7.3140 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -1.7830 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -4.3710 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -4.7090 0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -3.2970 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -3.0420 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -4.9010 -3.1480 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.7750 -3.6080 3.2400 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 21 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 31 32 2 0 0 0 0 31 48 1 0 0 0 0 33 34 2 0 0 0 0 33 49 1 0 0 0 0 M CHG 1 48 -1 M CHG 1 49 -1 M END