PUBCHEM-ZINC04531098 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.4760 0.0100 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 -1.4580 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -1.6030 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -3.0720 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.2070 -2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -4.5470 -2.6820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0230 -5.2100 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -4.6150 -3.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5010 -4.3680 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 -6.0300 -4.5320 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8430 -6.7390 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -6.3880 -4.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5270 -5.6880 -5.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -6.2890 -3.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6190 -6.9700 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -4.9520 -2.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -6.6890 -3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -7.9970 -4.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -8.1080 -5.5220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9720 -7.4610 -6.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -7.7190 -5.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -9.5360 -6.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -10.1350 -6.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -11.4450 -6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -12.1560 -6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -11.5560 -6.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -10.2450 -6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -6.0700 -5.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -3.6540 -4.9340 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6100 -2.3520 -4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -4.1400 -6.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -3.5100 -4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 0.3500 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.6130 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.1130 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -2.0610 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -1.7990 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -1.0000 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -1.2630 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -3.6740 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -3.4120 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -6.7040 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -5.9770 -4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -9.5800 -6.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -11.9140 -6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -13.1790 -7.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -12.1110 -6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -9.7750 -5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -6.9380 -6.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.4420 -4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -1.6190 -5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -2.0270 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -5.0700 -6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -3.3930 -7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -4.3200 -6.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -3.0280 -3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -2.9010 -5.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.4950 -4.8020 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 28 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 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M CHG 1 29 1 M END