PUBCHEM-ZINC05580297 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 0.2730 1.4020 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 0.0190 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -0.6390 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.1210 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 1.4350 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 2.0830 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -2.1150 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -2.7670 -1.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -2.7370 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -4.1330 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -4.8510 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -6.2290 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -6.8940 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -6.1820 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -4.8040 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 -4.0430 0.1210 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0950 -4.6350 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -2.8260 0.1390 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6220 -8.3720 0.3070 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5790 -9.0000 0.3070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -8.9590 0.3800 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5450 1.9440 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.5380 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -0.3730 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 3.1620 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -2.2170 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -4.3320 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -6.7880 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -6.7050 0.2820 H 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M END