PUBCHEM-ZINC06132156 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.5540 -0.6450 -5.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 0.6120 -4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 1.4060 -5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 2.5590 -5.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 2.9190 -3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 2.1250 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 0.9690 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 0.1010 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.4880 -2.6630 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1070 -0.1240 -3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -1.2070 -4.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -1.5970 -4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -0.9280 -4.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 0.1430 -3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 0.5540 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 1.5580 -2.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 2.2050 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 1.4740 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 2.3890 -1.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0790 2.4060 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 1.8860 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 1.0720 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 0.6110 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 0.9640 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 1.7770 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 2.2350 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 3.7090 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.4140 -5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.3790 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -1.0510 -6.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 1.1250 -6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 3.1800 -5.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 3.8200 -3.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 2.4060 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 0.2290 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -0.9430 -2.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.7350 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -2.4340 -5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -1.2480 -5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4020 0.6600 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 0.7970 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.0240 2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 0.6040 3.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2950 2.0530 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 2.8670 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 3.7560 -1.0370 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 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 41 1 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 9 1 M END