MAYBRIDGE-ZINC00161824 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -2.1590 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8720 -2.5860 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -2.3620 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -3.4170 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -1.1250 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -0.1780 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7320 1.5010 0.0500 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -2.7630 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -3.9440 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -4.4980 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -3.8700 3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -2.6890 3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -2.1330 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -0.9430 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -4.4340 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -5.4200 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -4.3040 4.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -2.1990 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -1.2080 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 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 22 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 M END