PUBCHEM-ZINC04114238 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 -1.2050 1.2180 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -0.2890 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -0.6030 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -1.9770 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -2.3710 -2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.5360 -2.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 -1.7100 -3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -0.8390 -3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 -1.0430 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -0.2970 -5.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3260 -2.0770 -5.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 -2.9030 -5.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -2.7220 -4.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -3.9470 -6.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 -2.3110 -6.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 0.2830 -2.8640 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1320 0.3760 -1.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 1.1140 -3.0740 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4390 -2.1710 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.1010 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -2.4850 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 1.7510 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 1.5180 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 1.4570 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -0.5890 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -0.8220 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -2.5980 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -3.4190 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -2.2230 -3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -0.8620 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -4.0920 -7.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -4.5420 -6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 -2.9740 -6.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7060 -2.7720 -7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 -1.3610 -7.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -1.0850 1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -2.7900 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -3.5000 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 -1.7960 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 -2.4310 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 16 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 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END