PUBCHEM-ZINC06166363 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.6860 2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.5210 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -1.1510 3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.5120 4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -1.9500 5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -2.0300 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -1.6780 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -1.2330 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -0.8270 1.2580 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9110 -0.7620 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 0.6180 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 0.6820 -1.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1410 1.8480 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 2.8950 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 4.0970 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 4.2640 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 3.2100 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 1.9830 -2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 0.9290 -3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 1.0960 -4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 2.3000 -4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 3.3480 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -1.4510 5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -2.2310 6.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -2.3740 4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -1.7450 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -1.5280 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -0.9300 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 1.3840 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 0.7860 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 2.7900 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 4.9100 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 5.2030 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7620 -0.0110 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 0.2830 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 2.4070 -5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1690 4.2760 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.2240 0.7840 H 0 0 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 13 1 M END