MAYBRIDGE-ZINC04336053 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2000 -0.1580 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -1.0170 -1.8170 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8260 -1.2440 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -2.3400 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -2.3320 -1.2460 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -0.3960 -3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 0.7120 -3.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -2.3180 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 -3.1990 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -0.0530 -1.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 0.8440 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -1.0750 -3.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 -0.6360 -4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 M END