PUBCHEM-ZINC05162520 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.1050 1.6320 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.2470 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -0.5480 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0560 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 1.4390 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 2.2260 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -0.9600 -0.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -0.1760 0.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -2.2410 0.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -1.2030 -1.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -0.0590 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -0.5140 -3.7590 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7710 -1.3580 -4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 0.6200 -4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 0.2050 -6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 1.3460 -7.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 0.9480 -8.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0220 2.0790 -9.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8770 1.7600 -10.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4580 0.6400 -10.5970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 -0.9920 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 -2.3480 -3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 -2.7700 -3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1840 -1.8180 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9040 -0.5010 -2.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6580 -0.1220 -2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 2.2490 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -0.2110 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -1.6270 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 1.9110 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 3.3040 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -2.0350 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 0.3430 -2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 0.7310 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 0.9190 -5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 1.5100 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -0.0980 -5.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -0.6650 -6.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 1.6090 -7.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 2.2370 -6.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 0.6680 -8.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 0.0600 -8.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 2.3340 -9.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 2.9740 -8.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 -3.0830 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -3.8170 -3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1890 -2.0970 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 0.9460 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8910 2.6780 -11.4610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 49 -1 M END