ASINEX-ZINC00848282 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2090 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4110 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 4.0870 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 4.3600 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 4.7810 3.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 4.8780 3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 4.4140 2.4220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 5.3020 4.9690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 5.6510 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 5.5940 5.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 6.1020 7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 6.4630 8.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 6.8840 9.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 6.9470 9.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 6.5900 8.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 6.1730 7.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 7.3980 11.0470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0760 7.7130 11.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 7.4550 11.2700 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2360 -2.5700 -0.0230 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.4970 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 3.9460 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 4.2440 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 5.3470 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 6.4140 8.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 7.1630 10.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 6.6410 8.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 5.9000 6.7380 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END