PUBCHEM-ZINC05829052 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 36 0 0 1 0 0 0 0 0999 V2000 0.0540 1.1830 -0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.0830 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 0.1980 -0.7830 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3830 1.0380 -1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -1.0860 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -1.7060 -0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 0.4900 0.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -0.3580 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 1.6980 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 2.7160 0.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 1.6730 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6630 1.4720 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 1.5640 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 4.0490 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 4.2760 0.6050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0080 5.1920 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 3.5300 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 5.1010 0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 4.9820 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 6.0290 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.0060 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 2.0170 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -0.6590 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -0.7180 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 0.8660 2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 2.6170 2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 2.3040 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 0.5370 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.6610 1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 0.7850 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 -1.3190 -2.6330 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.7080 1.4050 2.5210 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5500 0.6220 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6390 1.2600 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 2.2710 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 2.8150 1.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 2.7540 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 32 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 15 1 M CHG 1 31 -1 M CHG 1 32 1 M END