PUBCHEM-ZINC05919371 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 1.0290 0.3170 1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -0.2700 0.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6730 -1.3640 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.1820 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.0470 -0.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.4400 0.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -0.1920 0.6410 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4570 -0.2780 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 1.1800 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 1.9020 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0250 1.7860 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9740 2.4570 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 3.2470 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2110 3.3590 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 2.6880 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 -1.2860 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -2.0450 2.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.1880 -0.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -0.2850 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 -1.1200 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 0.3100 -1.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 0.1040 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -0.7700 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 -0.9170 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2690 -0.1900 -3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 0.6840 -4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 0.8300 -3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 0.0300 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 1.4120 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.0260 2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -1.1710 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 1.0940 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 1.8380 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 1.1560 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0310 2.3550 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3060 3.7660 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 3.9670 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 2.7760 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 0.8850 -1.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 0.9680 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 -1.3560 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 -1.6000 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 -0.3060 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 1.2530 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.5200 -4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -1.2970 1.2900 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 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 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 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 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M CHG 1 46 -1 M END