MDPI-ZINC03850350 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5780 -1.7280 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 -0.7110 -1.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6480 -0.1820 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 -0.0190 -1.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 -0.1630 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -0.0140 0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -2.1470 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9950 -2.1320 -3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1330 -1.0810 -3.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 -3.2870 -4.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -3.1960 -5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -4.5820 -5.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7570 -5.5500 -5.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -4.7600 -7.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 -6.0440 -7.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 -6.2020 -9.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2650 -5.0950 -9.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0440 -3.8210 -9.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 -3.6460 -8.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 -1.1490 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 0.6170 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2870 -2.6240 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -2.7040 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -2.7010 -5.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6240 -2.6210 -5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 -6.9090 -7.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2300 -7.1930 -9.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 -5.2250 -10.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 -2.9620 -10.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -2.6520 -7.7500 H 0 0 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END