PUBCHEM-ZINC05514596 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.1820 1.2690 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.1230 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -0.4160 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 0.1950 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 1.3430 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 1.8840 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 1.9860 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 1.4940 -0.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 2.2420 -0.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9070 3.3190 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 1.7690 -1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6170 1.7300 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3170 2.6970 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2490 3.7910 -2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 4.6520 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5150 4.4260 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5980 3.3530 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 2.4990 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6690 5.3170 -1.8440 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5340 6.2880 -2.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7110 5.0480 -1.2300 O 0 5 0 0 0 0 0 0 0 0 0 0 7.5600 0.4210 -0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6280 1.9370 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 0.8710 1.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -0.3640 -1.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 1.6810 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -0.3530 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -1.3080 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 2.7710 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 2.8800 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 3.9730 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2530 5.4820 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4960 3.1600 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5750 1.6650 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 0.3310 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 0.1910 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 2.7700 2.1760 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 25 36 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 37 -1 M END