ASINEX-ZINC04894778 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2070 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0210 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4100 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 2.1270 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 2.4910 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 2.2540 2.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 3.2450 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4660 3.2530 -0.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3400 2.7340 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 2.4980 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 2.2690 -2.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 4.9540 -1.4300 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 4.7310 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 6.0970 -3.9120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6030 6.6280 -3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 5.9070 -5.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 6.0380 -6.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -0.9060 -0.0390 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7620 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 4.2620 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 2.7210 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 4.2370 -3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 4.1190 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 6.4060 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 5.5910 -6.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 6.8780 -3.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 7.8080 -3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 5.4790 -7.0010 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 32 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 30 32 1 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 M END