OTAVA-ZINC05548946 MOE2007 3D CORINA 3.40 0006 02.08.2006 18 18 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3730 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 1.2530 -0.5500 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.7390 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.9590 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -1.9830 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -2.3920 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -1.4590 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 -1.8710 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 -0.9560 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -3.5960 -0.0690 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.9390 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.6020 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 3.0260 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -2.7020 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 -0.0060 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0360 -1.2590 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 -3.5530 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 12 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 M END