IBS-ZINC04823398 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.4280 2.2140 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 0.9710 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 0.2430 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 0.7520 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 2.0050 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 2.7340 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 2.5560 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 1.9180 -1.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 3.7660 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 4.2440 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 5.5030 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 5.9600 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 7.2990 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0970 7.7240 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0980 6.8290 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7850 5.4930 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4780 5.0590 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9340 4.8300 1.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8850 5.8550 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4410 7.0000 0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 3.3820 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2990 2.4710 0.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -0.2460 -1.8840 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 2.7790 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 0.5690 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.7260 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 3.7040 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 4.3050 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 6.1710 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 7.9980 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3430 8.7580 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2340 4.0260 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 6.0640 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8900 5.5630 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4530 3.5990 -1.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 3.0050 -2.0220 H 0 0 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 7 1 0 0 0 0 6 27 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 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 21 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 35 36 1 0 0 0 0 M END