PUBCHEM-ZINC05735782 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 0.1290 1.6280 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.1060 0.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9910 -0.2130 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -0.3840 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -1.2570 0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -1.2890 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -1.9360 -1.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.5430 -1.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -1.8910 1.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -1.5630 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 -0.4700 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7970 -0.0190 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 1.0890 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 1.3220 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 0.3900 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.4390 -1.6920 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4290 3.3010 -2.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 2.5660 -1.7480 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1710 1.9280 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.9520 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 2.0900 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 0.4570 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -0.9490 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.4450 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -2.1520 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -0.4740 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4230 1.6820 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END