IBS-ZINC05478727 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.3750 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 1.9390 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 1.2710 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.5340 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 0.1400 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -0.6500 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 0.0490 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 1.3550 -0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1140 1.9040 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 3.1120 -0.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2270 0.9400 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 1.1990 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5110 0.0890 -0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8760 0.3620 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7660 -0.6930 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2670 -1.9870 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9030 -2.1860 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0760 -1.1670 -0.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4190 -0.6390 -0.3000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9020 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 2.9040 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 1.7120 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -1.4990 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -0.2980 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -1.6160 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 2.2210 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2310 1.3820 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8260 -0.5140 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9360 -2.8320 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 -3.1930 -0.6200 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 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 M END