PUBCHEM-ZINC05741794 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.5580 1.5410 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 0.1140 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -0.6860 1.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -0.0470 2.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -0.9110 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -2.0750 3.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.2500 4.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -1.0350 5.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -0.2530 6.8850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7510 0.2640 6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -1.1040 8.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8540 -1.6720 8.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -0.0740 9.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7770 0.4250 9.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 0.9830 8.6360 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7460 1.9840 8.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 0.7790 7.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 1.0340 9.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 0.1730 8.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 0.4860 9.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 1.6000 10.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 1.9670 9.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 3.0160 10.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 3.6960 11.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 3.4520 11.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 2.3890 10.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 2.1270 11.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -0.6830 10.3470 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1610 -2.0380 8.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -1.9590 9.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.4060 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 1.5610 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 2.0080 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 2.1110 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -1.2310 5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -1.9770 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -0.6610 8.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 4.5550 11.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 1.3370 10.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 2.7330 11.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.3450 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -1.4460 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 0.2050 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 29 30 1 0 0 0 0 31 41 1 0 0 0 0 31 42 1 0 0 0 0 31 43 1 0 0 0 0 M CHG 1 28 -1 M END