PUBCHEM-ZINC05012542 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 0.1310 1.0570 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.2070 1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -0.4230 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 0.7130 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.6690 0.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 3.0790 -0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9620 3.5340 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 3.3450 -1.6000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0230 2.5910 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 4.6780 -1.8200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6000 4.8760 -2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 4.5130 -0.9640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1640 3.9280 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 3.7080 0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 5.8060 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 5.4810 0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 4.7510 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 5.7420 -1.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 5.3030 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 3.5320 -1.7660 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2760 0.9930 -0.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -1.7070 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -2.7510 0.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 1.5810 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 6.3570 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 6.4550 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 0.3550 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 1.9200 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 21 27 1 0 0 0 0 21 28 1 0 0 0 0 22 23 3 0 0 0 0 M CHG 1 20 -1 M END