PUBCHEM-ZINC06201727 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 0.2030 1.5380 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.0500 -0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2710 -0.5320 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.2370 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -0.4710 1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -0.1950 -0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -0.3670 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.0020 -1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -0.4160 1.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -0.6830 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -0.5000 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -1.2110 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1200 -1.3770 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -1.8700 3.3470 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3080 -2.8730 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 -1.9040 4.6770 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1320 -0.9130 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -2.3970 4.4730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1750 -2.3790 5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -1.5660 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -3.7690 4.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -4.2020 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -2.8070 5.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -2.5420 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -0.9600 3.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 -1.2990 3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6520 -2.4110 2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 -0.1470 3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4910 -0.4640 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 1.7630 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 1.8790 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 2.1310 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -0.5440 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -1.1610 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 -0.6330 3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -2.1370 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9040 -0.0320 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8030 0.7640 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6310 0.0050 4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1030 -1.2800 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1820 -0.7100 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3760 0.7250 2.0380 N 0 3 0 0 0 0 0 0 0 0 0 0 11.1750 0.5270 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7660 1.0040 2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8830 1.5360 1.6410 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 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 29 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END