PUBCHEM-ZINC00240952 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -1.2820 0.8530 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.4490 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -0.4930 -1.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 0.0340 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -0.8740 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.9950 -3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -1.4130 -3.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -1.0180 -3.9330 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3580 -0.0690 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -2.1920 -3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -2.3050 -4.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -2.4000 -6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -1.1320 -5.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -1.1910 -7.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -1.0660 -8.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -2.1760 -9.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -2.0780 -10.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 -0.8700 -10.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 0.2410 -9.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 0.1510 -8.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 1.5150 -10.1300 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3760 1.5960 -11.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3290 2.4330 -9.3350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6730 1.7160 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 0.9830 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 0.8590 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -0.5720 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -1.2890 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 0.1870 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 1.0210 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -1.8980 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -0.4990 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -0.9150 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -2.0850 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -3.1280 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -1.4340 -4.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -3.1880 -4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -2.3800 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -3.3060 -6.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0300 -5.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -0.2480 -5.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -0.3340 -7.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.1020 -7.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -3.1330 -9.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 -2.9470 -11.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 -0.8160 -11.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 1.0250 -8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -1.2100 -6.3300 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0990 -0.3620 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 48 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 48 1 M END