MDPI-ZINC02173223 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0820 -0.0140 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -2.0660 -0.0740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2310 -2.4200 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -2.0180 1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -0.6630 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 0.1280 2.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -3.0180 2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -2.6790 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 -3.6680 4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 -4.9940 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9310 -5.3350 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -4.3500 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -2.7510 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -3.1810 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -3.8100 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -4.0080 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -3.5770 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.9440 0.9920 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -1.6430 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -3.4050 5.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -5.7660 4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8930 -6.3710 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -4.6160 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -3.0270 -2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -4.1470 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -4.5000 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -3.7320 1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -2.6040 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 16 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 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 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 M END