PUBCHEM-ZINC02047394 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.1750 1.7270 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 1.9710 -1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 2.7580 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 2.9270 -3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 2.2870 -4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 1.5270 -4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.4110 -2.8370 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7200 2.4480 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 3.5500 -6.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 3.2090 -7.2280 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 2.2470 -8.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9640 3.8040 -3.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 4.3590 -1.6230 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0310 3.2890 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 5.1390 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 6.4320 -0.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 7.2170 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9050 4.8540 -2.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 5.4010 -3.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6130 3.2980 -0.6990 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8010 1.2170 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 1.0940 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 2.6730 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.0220 -4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 1.5210 -6.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 2.6320 -5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 4.5850 -3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 3.1660 -3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 5.2530 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6030 4.6050 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 7.3910 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 6.7250 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 8.1820 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 0.8860 -2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 4.5620 -7.7960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2150 2.5650 -6.3390 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.4070 4.5070 -2.0010 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.7680 4.1300 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 5.5110 -2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1080 4.6140 -2.3440 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 13 37 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 20 -1 M CHG 1 35 -1 M CHG 1 36 -1 M CHG 1 37 1 M CHG 1 40 -1 M END