PUBCHEM-ZINC01088791 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.7510 1.3040 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.1660 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -0.5300 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.9530 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.9090 -0.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2340 -2.4660 0.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1140 -2.3620 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -1.1160 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -3.4890 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -4.2230 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -5.1610 0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -5.3660 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 -4.6320 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -3.6900 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -6.3720 -0.6840 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7940 -7.0190 0.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6760 -6.5520 -1.8300 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4200 -4.3120 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -4.9090 0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -4.9020 -0.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -6.2650 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 -6.6880 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -6.4450 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5800 -6.8320 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -7.4630 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 -7.7070 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -7.3230 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.8620 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.8850 -2.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 1.8630 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 1.4730 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 1.6390 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 0.2380 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -2.1380 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -2.1240 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -0.6980 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -1.2610 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -4.0630 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -5.7350 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -4.7920 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -3.1140 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -4.4240 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -6.2950 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -6.9440 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -5.9520 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -6.6420 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 -7.7660 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -8.2000 -3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -7.5170 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -1.6840 -2.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -1.7040 -3.2810 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 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END