ASINEX-ZINC04859565 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.2030 -0.6760 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0360 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 1.4360 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 1.9670 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 1.1610 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 -0.5080 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 1.5820 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 0.6450 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4410 1.0640 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4530 0.0980 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7740 0.5100 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0440 1.8710 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9940 2.7740 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7450 2.3600 -0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3760 2.9740 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 4.0790 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.9040 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 1.2170 -1.7560 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 -0.4050 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2060 -0.9530 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5760 -0.2120 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0650 2.2240 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2030 3.8340 -0.0760 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 18 19 3 0 0 0 0 M END