MDPI-ZINC03851287 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 0.3050 1.1070 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.2800 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -1.0810 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -0.5010 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 0.8960 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 1.6960 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -1.3600 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -1.2790 -1.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 -2.2090 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -3.1610 -0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 -2.0930 -2.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1640 -2.5820 -3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -2.8460 -3.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4530 -3.7130 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6670 -3.0460 -4.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0220 -1.8380 -4.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -0.8800 -3.7780 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4770 -0.0060 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -0.7130 -3.5390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8160 -0.6270 -4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 0.6040 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 1.5010 -2.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1860 -1.7650 -2.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.7290 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -0.7400 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.1620 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 1.3670 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 2.7760 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -1.0410 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -2.4090 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -0.4420 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 -3.9690 -5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3180 -1.5790 -5.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 0.6420 -2.4620 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 M CHG 1 34 -1 M END