PUBCHEM-ZINC03644659 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.3860 1.4930 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 0.0430 0.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7930 -0.9960 1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.1140 0.8930 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4740 -0.1760 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 0.0680 1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -0.6880 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 0.2610 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -0.3850 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1260 -1.5530 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -2.2170 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -1.7110 -4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -0.5720 -4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 0.1230 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.2460 -4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 1.9380 -3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 3.0210 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 3.4840 -5.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 4.5860 -5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 5.0710 -6.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 4.4560 -7.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 3.3580 -7.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 2.8270 -6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 1.6920 -5.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 0.9710 -6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -0.1430 -6.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 1.6820 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 2.1930 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.7390 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -0.5100 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -1.0230 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 0.5120 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -1.1910 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 0.1030 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 1.3450 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -1.9430 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -3.1060 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -2.2270 -5.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 1.6440 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 3.4930 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 5.0780 -4.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 5.9230 -7.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 4.8250 -8.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 2.9300 -8.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 1.2340 -7.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -0.6660 -6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.3120 -0.7060 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8300 -1.3230 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.4020 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 47 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 26 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 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 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 4 -1 M CHG 1 47 1 M END