CHEMDIV-ZINC00138681 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0630 1.2260 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.1190 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -0.6360 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 0.1730 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 1.5440 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 2.0490 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 2.5240 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 3.4150 -1.6120 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 4.1670 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 4.4000 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4010 4.1290 -3.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1090 4.9940 -2.5320 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6410 5.1650 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6580 5.3790 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7500 5.9410 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 5.1140 -0.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 5.3810 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 4.5140 -0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 -0.4920 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 0.2430 -1.1620 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0400 1.6380 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.7710 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -1.6940 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 3.1030 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 3.2660 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 2.0400 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -1.7580 -0.6400 O 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 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 27 2 0 0 0 0 M CHG 1 20 -1 M END