PUBCHEM-ZINC04159856 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.4640 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.0780 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -0.6560 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 0.0490 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.4360 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 2.1550 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.8090 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 0.6430 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -0.4020 0.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -1.3670 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 3.1970 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 3.9860 1.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3930 3.9520 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 5.4310 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 5.7750 0.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 3.4510 2.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 2.5260 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 2.1780 3.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 1.9070 3.9850 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8150 1.2530 3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3770 2.9790 4.4110 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9280 3.7160 5.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5660 2.3040 5.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6870 2.8020 4.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9180 3.6740 3.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 1.0800 5.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 2.0190 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -0.4390 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -1.7330 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 3.2360 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 0.4770 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 3.1360 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 3.7200 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3440 3.8070 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 3.7070 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 0.9590 5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 6.0910 0.5830 O 0 5 0 0 0 0 0 0 0 0 0 0 8.2580 1.3490 5.9110 O 0 5 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 25 35 1 0 0 0 0 26 36 1 0 0 0 0 M CHG 1 37 -1 M CHG 1 38 -1 M END