PUBCHEM-ZINC05829268 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 39 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.7170 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 0.3190 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.0460 -2.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9270 0.0680 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -1.4660 -2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -2.0760 -3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -2.2560 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 2.0800 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 4.0360 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 5.3000 1.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 3.5050 2.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 4.1420 2.9490 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4620 5.3060 3.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 3.4480 3.2560 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0200 2.4670 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 1.7800 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 0.2620 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.4160 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -1.6040 -3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -2.2360 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -1.3460 -2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -3.0310 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -1.3100 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -2.9970 -5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 1.3820 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 2.0190 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 5.8610 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 5.6920 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 2.5580 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -1.6190 -3.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -2.3500 -4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -2.7490 -4.2420 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2780 -3.6650 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9640 -2.8710 -5.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8050 -2.0970 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 0.8890 -3.3160 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0870 -3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 1.7800 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 0.3940 -4.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 3.4380 0.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 36 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 6 30 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 7 32 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 40 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 32 1 M CHG 1 36 1 M END