CHEMSTAR-ZINC04122584 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0750 -2.9920 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.1260 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.7510 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0410 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.5820 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -1.9710 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.6920 -0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6110 -2.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -3.9520 -2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -4.8810 -1.0700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -4.5610 -3.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -5.9020 -3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -6.5620 -2.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -6.5690 -5.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -5.8120 -6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -6.4370 -7.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -7.8180 -7.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -8.5790 -6.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -7.9590 -5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -9.9320 -6.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -10.6490 -5.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -8.4290 -8.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -7.5890 -9.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.0450 2.9450 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.2120 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -3.9220 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.4650 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.1180 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.0030 -2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -2.0920 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -4.0350 -4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -4.7380 -6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -5.8510 -8.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -8.5470 -4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -10.4660 -4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -11.7160 -5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -10.3120 -4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -7.0400 -9.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -6.8850 -9.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -8.2020 -10.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 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 31 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END