PUBCHEM-ZINC05138929 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 0 0 0 0 0 0999 V2000 0.0970 1.3680 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.0270 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -0.6350 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 0.1360 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 2.1170 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.6470 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 4.1480 0.0680 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9110 -0.5860 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -1.8630 -0.0950 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.7250 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -2.1760 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -2.5940 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.4010 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -4.4110 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 1.8880 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -1.7170 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -0.1750 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -2.5660 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -2.5900 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -2.2050 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -2.1810 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 1.5000 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 4.3310 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 0.1120 -0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 8 1 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 22 2 0 0 0 0 6 7 1 0 0 0 0 6 23 2 0 0 0 0 8 9 1 0 0 0 0 8 24 2 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 M CHG 1 7 -1 M CHG 1 9 -1 M END