PUBCHEM-ZINC03738057 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 1 0 0 0 0 0999 V2000 2.2430 2.3930 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 1.0390 -1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.5510 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 1.2640 0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 0.6640 2.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -0.6730 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -1.4140 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -0.7890 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -2.7140 1.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -2.7390 3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -1.4970 3.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -1.2110 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -3.9020 4.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1030 -3.7300 4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -4.9210 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.9090 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -4.1550 4.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -4.3840 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -4.6580 6.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6770 -4.6970 5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6160 -4.4960 4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -4.2230 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9130 -5.0020 6.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 -4.4510 7.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 -5.3180 8.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 -4.8070 9.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 -3.4320 10.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5640 -2.5640 9.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1990 -3.0720 7.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 2.5460 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 2.6210 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 3.0750 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 2.3030 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 1.2280 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -1.3380 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -4.5700 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.8950 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -3.6170 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -4.3790 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -4.3590 6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 -4.8500 7.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 -4.5490 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -4.0610 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 -6.3870 8.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3660 -5.4780 10.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2640 -3.0350 11.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5340 -1.4930 9.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9000 -2.3900 7.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -5.1410 3.2690 N 0 3 0 0 0 0 0 0 0 0 0 0 3.1810 -5.4850 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -5.8760 3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 49 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 49 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 M CHG 1 49 1 M END