PUBCHEM-ZINC04264956 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8640 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1170 0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -1.9480 -0.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7780 -1.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.4270 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.4880 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 0.1710 3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 0.5260 4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.2330 5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -0.4330 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -0.7960 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -0.7140 5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.3390 6.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 0.2810 7.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 0.5670 6.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -1.3600 5.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -1.6400 5.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5790 -2.3590 5.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 -2.6480 6.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8310 -1.8920 6.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 -2.4710 7.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5130 -2.1100 7.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1010 -3.6450 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 -3.8020 7.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 -4.9130 7.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 -5.8500 8.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7120 -5.6890 8.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5140 -4.6010 8.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 -6.9330 8.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -7.8630 9.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -3.7560 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -4.1750 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -3.2950 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 0.4000 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 1.0340 4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -1.3080 2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 0.5640 8.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -1.6280 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8590 -0.7040 6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -2.2740 6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -3.2950 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -1.7250 4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0290 -0.9650 5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 -5.0380 6.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0360 -6.4270 9.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4570 -4.4860 9.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 -8.2640 9.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -7.3570 10.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5020 -8.6780 9.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END