NCID-ZINC04775703 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -1.5150 -1.0930 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -1.6100 0.5860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3110 -1.9540 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.4830 1.1310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8270 0.3310 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.0040 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.9680 2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 0.0090 2.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 1.3310 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 2.1430 2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 3.4490 2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 3.9490 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 3.1430 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 1.8370 3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.9770 4.6930 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7300 1.4450 5.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -0.1980 4.4010 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1200 5.3490 3.9860 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8690 6.0600 3.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 5.7900 4.9760 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.9880 1.7660 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.2100 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -1.8680 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -0.8330 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -0.5830 2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 1.7540 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 4.0820 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 3.5360 5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.4270 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -1.5090 0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -1.8310 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 18 1 M CHG 1 20 -1 M END