PUBCHEM-ZINC05668889 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.8000 -0.4020 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.0950 -0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 1.6980 -1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 1.8080 -1.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8150 1.2830 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 1.9590 -2.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5450 1.3420 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 3.3460 -2.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 4.1250 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 5.3080 -1.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 3.2200 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 3.6090 0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 3.8430 -3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 3.2170 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 3.7620 -5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4020 3.0710 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2110 3.5780 -6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5770 2.9030 -6.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8740 2.0040 -5.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 1.5570 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 0.4250 -4.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 0.0280 -5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.7710 -5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 1.9040 -5.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.2930 -4.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 0.3550 -6.9220 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5030 -0.7020 -7.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 1.0820 -7.2200 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.8510 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.8040 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.6500 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 4.9320 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 3.6370 -4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1550 2.1290 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 3.4070 -2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1820 4.8440 -4.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 3.6020 -5.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 1.9870 -5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9650 3.2360 -4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3810 4.6570 -6.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6420 3.4240 -7.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -0.1580 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -0.8530 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 2.4940 -5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 3.1760 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2450 3.3400 -7.5030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 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 16 17 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 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M CHG 1 46 -1 M END