MDPI-ZINC03844362 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 0.3230 1.0710 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -0.4390 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -0.7210 -0.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -2.0090 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -2.8730 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -2.3780 -2.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5520 -2.0330 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.7170 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.2200 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 0.2690 -2.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -3.8750 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -4.5850 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -5.9430 -2.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -6.5780 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -7.7860 -2.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -5.8950 -2.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -4.5560 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 -3.9380 -2.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -6.6100 -2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -6.7140 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -3.8840 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 1.4410 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 1.5660 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.2820 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -0.9340 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.8090 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -2.0540 -4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -1.9920 -3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -7.6770 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -6.4430 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -6.2420 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -6.9410 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -7.6430 -3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -6.1310 -3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -3.0420 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -4.5820 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -3.5220 -3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 0.5720 -4.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 1.5260 -3.9120 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 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 38 39 1 0 0 0 0 M END