ASINEX-ZINC04998744 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0080 1.4010 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.1260 0.4890 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5480 -0.5560 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.5690 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 0.0870 2.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -0.2600 4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -0.5840 0.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -1.4850 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -1.3370 -0.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7760 -0.5770 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -0.8820 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -0.2380 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 0.4860 2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1250 -2.6560 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -3.6480 -1.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 -2.7350 -1.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -3.9330 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3080 -4.2910 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9180 -5.4730 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 -6.3010 -2.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1020 -5.9470 -2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -4.7620 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 -7.9200 -2.6340 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 1.7420 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 1.7170 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 1.8320 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -1.6480 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -0.3060 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -1.3320 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 0.0100 4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.2800 4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -1.1860 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -2.5140 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -0.1590 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9550 -1.7400 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -1.9610 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7780 -3.6450 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8650 -5.7520 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6330 -6.5950 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -4.4840 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END