PUBCHEM-ZINC02979552 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.9840 1.8420 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 0.2340 -0.0670 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.3460 1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 0.4010 -0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -0.6000 -1.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -1.0800 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -2.5240 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -3.2420 -0.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -2.8940 -0.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -4.1110 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -5.2020 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -6.3730 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 -6.4570 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -5.3720 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5980 -4.1860 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -3.0030 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 -1.9640 -1.0060 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2010 -0.4720 -2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -1.3910 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -1.3060 -4.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -0.2980 -5.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.6250 -4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 0.5310 -3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 1.4150 -3.2730 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 1.7420 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 2.3230 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 2.4340 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -1.0240 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 -0.4510 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -2.2000 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -5.1650 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -7.2180 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -7.3680 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 -5.4480 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -2.1790 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -2.0270 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -0.2360 -6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 1.4120 -5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -3.1230 -0.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 2 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 17 -1 M END