PUBCHEM-ZINC03869720 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0760 1.7800 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.3180 0.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2410 0.2380 1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -0.4930 0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1140 0.0610 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -0.9460 -1.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9700 -0.1420 -2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -1.1770 -1.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2660 -0.9860 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.2620 -0.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -2.5000 -0.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -3.6480 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -4.7110 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -5.9490 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -6.9560 -0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -5.9030 -2.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.7300 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -4.8200 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -4.8390 -4.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -3.7300 -2.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.9210 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -4.7710 0.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -2.1070 -1.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -2.8550 -1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -1.6400 0.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -2.1490 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 2.5030 0.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 4.0850 0.1870 P 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 4.0480 -1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 1.8760 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 2.2020 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.5510 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -3.9590 1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -5.6590 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 4.6530 0.6740 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3170 4.6070 0.9290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 35 1 0 0 0 0 28 36 1 0 0 0 0 M CHG 1 35 -1 M CHG 1 36 -1 M END