PUBCHEM-ZINC06177599 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 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 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.6730 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -4.0410 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -3.7220 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -2.3530 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -1.4340 3.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4460 -0.5370 2.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -2.1220 4.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -3.0250 5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -4.0940 5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 -4.9510 6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -4.7530 7.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -3.6960 6.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -2.8350 5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -1.7110 5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -1.0580 4.4150 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1400 -0.0670 4.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.9170 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 1.7960 3.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 1.7310 4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 0.7710 5.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -0.1320 5.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -1.1810 6.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -1.4880 7.1080 H 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 -1.0200 -0.3810 0.0100 H 0 0 0 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 -0.2590 -2.2640 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -4.7020 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -5.6360 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -4.1340 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -1.9460 3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 -4.2570 4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -5.7850 6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -5.4280 8.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -3.5420 7.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 0.9800 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 2.5670 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 2.4500 4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 0.7260 6.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 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 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 20 1 M END