IBS-ZINC05451313 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8450 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.5970 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -1.6430 3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -2.9540 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.2220 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1730 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.1220 -0.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.8900 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7990 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.3270 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 0.8660 -2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -1.2160 -3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.7450 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.9470 -5.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -1.4560 -7.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -2.5780 -8.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.2280 -9.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.3040 5.2580 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 0.4180 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -3.7700 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.2440 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.1670 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.1540 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -0.1300 -5.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -2.5380 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -2.5630 -5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -0.8650 -7.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -0.8400 -7.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.1350 -10.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -1.6530 -9.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -1.6280 -9.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 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 24 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 M END