PUBCHEM-ZINC00525860 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.4580 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7610 -0.6300 1.1170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4990 -0.2030 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -2.1420 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -2.6970 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -1.9070 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.3980 -1.2060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5160 0.2060 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -0.2310 -0.7820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8490 0.5240 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -0.3840 0.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8330 0.2540 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -1.3360 -0.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -4.0950 -0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -4.8870 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -4.4270 -1.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -6.3500 -1.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2800 -6.4550 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -7.0180 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -6.4720 0.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -7.0090 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -7.6190 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -8.2240 -3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -8.2190 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -7.6080 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -6.9990 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.5390 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.8400 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.8960 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.7210 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -2.6320 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -2.3240 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -2.6090 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.2300 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0780 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -8.0910 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -6.8360 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -6.8500 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -7.6240 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -8.7020 -4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -8.6920 -4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -7.6040 -1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -6.5190 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -0.1180 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -1.6240 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -0.2730 0.8540 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 8 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 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 6 15 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M CHG 1 2 1 M END