PUBCHEM-ZINC05379730 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7200 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1010 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7370 -0.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0890 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7070 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8640 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2020 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 -4.6910 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -6.2210 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -6.6900 -0.3080 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3130 -7.5940 0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 -6.1740 -1.1270 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.2050 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.6660 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1820 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -3.0640 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -2.2800 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -3.8070 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -4.5760 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -4.5690 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9220 -4.3170 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -4.3240 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -6.5950 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -6.5880 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 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 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 5 1 M CHG 1 12 1 M CHG 1 14 -1 M END