PUBCHEM-ZINC06761070 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.6460 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 0.1560 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4550 -0.0560 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -0.3980 -0.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 0.5640 0.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 1.7010 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 2.9720 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 4.0220 0.5520 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.4760 -0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -2.0030 -0.9530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2830 -2.3590 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -2.7100 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -3.7000 -0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.9620 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 2.2460 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -0.1270 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -0.1220 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 2.8880 1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.2570 -2.8080 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2310 -2.5800 0.4500 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8540 -3.4270 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -2.0200 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -2.8910 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 M CHG 1 8 -1 M CHG 1 19 -1 M CHG 1 20 1 M END