ASINEX-ZINC04454197 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 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 -0.8250 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1240 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1090 -0.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.8870 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7690 -1.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -3.1760 1.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -2.9230 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -1.6840 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.4490 2.5810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7880 0.3150 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 0.0730 2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -0.7330 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -0.2540 3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 1.0320 3.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 1.8410 3.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 1.3600 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 2.1520 3.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 3.4670 4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 4.1920 4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 5.4310 3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 -1.3580 3.0400 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -1.5390 4.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -1.4240 5.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -3.9850 3.6560 N 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 -2.3400 -1.7370 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 1.4050 3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 2.8450 4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 4.0130 3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 3.3980 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 3.6910 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 5.9330 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 5.9510 3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -4.8860 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -3.8350 4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 11 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 2 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 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 24 25 3 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END