MDPI-ZINC03844760 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 1.3230 0.6540 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.7660 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -1.3820 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.6670 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -3.3310 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -4.6510 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -5.2680 -2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -4.5900 -3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -3.3050 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.6460 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -1.3850 -2.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -5.2570 -5.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -6.4390 -5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -7.3510 -3.9680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0820 -7.6580 -4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -6.5850 -2.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -7.1410 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -6.4330 -0.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -8.6100 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -9.1830 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -10.5550 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -11.3640 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -10.8030 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -9.4320 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -8.5840 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.6500 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 1.1520 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 1.1850 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -0.8440 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -3.1610 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -5.1820 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -2.7910 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -4.5340 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -5.6120 -5.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -6.0740 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -6.9990 -6.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 -8.5520 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -10.9990 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -12.4380 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -11.4400 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -8.9960 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -8.6770 -4.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -9.4740 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -8.4790 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END