PUBCHEM-ZINC03871263 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.1590 0.5190 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.7340 -0.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.2190 0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -0.3830 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 0.8780 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 1.3930 -1.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 1.4910 -0.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 0.5710 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -0.5610 0.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 0.8550 0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 -0.1510 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6450 0.3920 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5650 -0.6510 1.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9880 -0.1170 1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8990 -1.1660 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3150 -0.6360 2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 2.8610 -0.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4200 3.1750 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 3.1630 -2.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4730 2.9670 -2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 4.6310 -2.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6780 4.9140 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 4.7350 -1.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1040 4.4810 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 3.6960 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 6.0380 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 7.0820 -0.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 7.5950 -2.3350 P 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 6.6430 -3.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 5.4210 -1.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 6.3870 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 2.4130 -2.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 2.3490 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -2.5030 0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 0.8620 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 1.7430 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8320 -0.4390 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -1.0470 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 0.6870 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6270 1.2970 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 -0.9450 2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -1.5530 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3900 0.1730 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9720 0.7850 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4940 -1.4580 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9120 -2.0690 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7770 -0.3890 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3520 0.2330 3.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 5.8420 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 6.3900 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -3.0460 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -2.8690 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1530 -1.6900 3.4130 N 0 3 0 0 0 0 0 0 0 0 0 0 14.1220 -1.3690 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1840 -2.5370 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7900 -1.9600 4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 9.0320 -2.3770 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2880 7.4230 -2.3560 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 35 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 51 1 0 0 0 0 34 52 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 53 56 1 0 0 0 0 M CHG 1 53 1 M CHG 1 57 -1 M CHG 1 58 -1 M END