OTAVA-ZINC04226938 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.1440 1.2790 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.0810 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -0.5140 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -2.4920 -2.8210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0850 -2.0490 -3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -2.3950 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -3.7600 -3.4130 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 -4.3430 -2.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -3.3180 -4.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -4.8110 -3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -3.9940 -2.7430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0480 -4.1210 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -4.2850 -1.4500 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1090 1.2570 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 2.0470 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 1.5750 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -0.8180 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.0320 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 0.1790 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -0.5990 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 -1.4620 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -2.5350 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -5.0560 -4.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -5.7370 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -1.8370 -1.7700 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5120 -2.6280 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -1.8700 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 13 -1 M CHG 1 25 1 M END