CHEMBRIDGE-ZINC04725626 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.8310 1.3730 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -0.0900 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -0.8050 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -0.3690 2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -2.2200 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -3.3070 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -4.6430 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -4.7850 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -6.0400 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -7.1650 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -7.0300 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -5.7800 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -8.2320 1.8610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2490 -8.1150 3.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -9.3380 1.3560 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.2020 -0.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -0.9170 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -0.4050 -2.3260 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 1.7660 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 1.6740 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 1.7670 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -3.1900 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -3.9120 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -6.1500 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -5.6760 2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -2.9780 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -8.4000 -0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -8.8130 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END