PUBCHEM-ZINC00579992 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -1.7140 -1.3750 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -0.3870 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 1.0440 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -0.6150 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.3810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -1.6740 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 0.7090 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.0410 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -1.2980 -2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 -1.1970 -1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8830 -1.6520 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 0.1770 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -2.0780 -2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -3.2590 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -4.0680 -3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -3.6950 -4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -2.5130 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -1.7020 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -4.5610 -5.4450 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7680 -5.6020 -5.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -4.2320 -6.5900 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2720 -1.2050 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -2.3940 1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -1.2300 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -0.5320 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 1.7480 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 1.2140 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.1890 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -0.0610 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -2.0090 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -1.4930 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -2.4420 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 1.6430 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 0.8500 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 0.4100 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 0.6000 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 0.0730 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 0.8380 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -3.5510 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 -4.9910 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -2.2220 -5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -0.7780 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END