PUBCHEM-ZINC05411890 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 2.0710 0.1300 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -1.2640 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -1.6340 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -2.9500 1.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9390 -3.7710 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -3.0160 2.0810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2160 -2.0650 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -3.2910 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -2.2900 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -4.7100 3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -4.1130 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -4.9860 0.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -4.0160 2.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -5.1490 2.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7810 -5.4740 1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -4.7620 3.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6940 -5.6050 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -4.4400 4.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3280 -3.5050 4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -5.6030 5.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8730 -6.4780 5.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -5.9090 4.7200 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1870 -5.0530 4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -6.2470 3.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -7.0540 5.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -7.7230 4.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -5.2580 6.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -6.0020 7.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 -4.2150 5.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 -4.2730 6.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 -3.6490 2.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -3.3640 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -2.2200 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -2.9500 -1.5830 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1380 0.1250 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.5610 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 0.7970 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -0.8630 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -1.3090 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -2.6410 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -2.1590 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -4.7700 3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -5.0280 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -5.4270 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -7.1300 6.7130 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6500 -2.1240 -2.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 46 2 0 0 0 0 M CHG 1 34 -1 M CHG 1 45 -1 M END