ASINEX-ZINC05027412 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 -0.1840 1.1480 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.1830 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -0.8110 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -0.0840 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 1.2480 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 1.8630 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 2.2350 -2.0740 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -2.2350 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -2.9570 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -4.2540 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -4.2700 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -3.0350 -0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -5.3840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -5.2290 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -3.9790 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -2.8900 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -4.1120 0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -5.3730 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -5.6850 0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -6.5000 0.2380 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 1.6330 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.7400 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -0.5620 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 2.9050 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -2.5940 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -5.0840 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -6.3580 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 -3.3320 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -6.6160 0.5110 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 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 25 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 29 1 0 0 0 0 M END