SIAL-ZINC00408124 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1600 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4540 -3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8370 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.6130 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0040 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -2.8290 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.2960 0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -4.1730 -0.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -4.9460 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -4.4580 1.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -3.5230 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -5.5460 2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -5.6840 3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -6.9420 4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -8.0730 3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -7.9550 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -6.6870 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -6.2550 0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -2.6610 -4.6940 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2380 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 0.1470 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -3.6900 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.5980 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -4.8080 4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -7.0480 5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -9.0530 4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -8.8390 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 M END