IBS-ZINC05451488 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0510 1.4970 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.0320 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -0.5380 -0.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -1.8740 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -2.5990 -0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.4090 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -3.8660 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8170 -4.2140 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -3.3500 1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 -1.8930 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -1.5450 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2420 -3.8850 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3860 -5.0910 1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4170 -3.0100 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7740 -2.3280 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9580 -1.6090 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7710 -0.7480 2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8780 -0.1900 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2080 -0.4680 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4250 -1.3100 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2910 -1.8910 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3320 -2.7460 0.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 -3.1060 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9720 0.9700 3.3850 Br 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -2.3370 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.8760 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.8270 -1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8770 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -0.4130 -1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.3620 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -4.2000 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -4.3550 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -5.2590 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -4.0460 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -1.4040 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 -1.5590 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -0.5010 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 -1.7090 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5220 -0.5280 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0870 -0.0180 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6900 -1.5200 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 -1.5370 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7520 -2.1830 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5410 -3.2960 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END