MDPI-ZINC03847258 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 1 0 0 0 0 0999 V2000 -0.0350 1.6110 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.2230 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.5350 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 0.1140 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 1.4970 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 2.2630 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 1.9330 0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0350 2.6500 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 2.5030 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 2.5960 -1.6440 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0470 3.3170 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 1.3120 -1.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 0.4960 -0.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5670 0.8950 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 0.5690 0.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5550 0.4210 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -0.4550 -0.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4490 -0.8730 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 -0.5270 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 0.8000 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 1.3140 -2.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 3.1520 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 2.4040 -4.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 2.1830 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -0.2660 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.6070 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 3.3370 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 1.8750 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 3.4930 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -1.3990 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -1.5140 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -1.4010 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5670 -0.3870 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9150 -1.2820 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 4.3350 -3.1790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 22 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 M CHG 1 35 -1 M END