MDPI-ZINC03843427 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 -0.6830 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.0220 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4310 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.1880 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7090 1.5890 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 3.5320 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 4.1960 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 4.2190 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 3.6040 -1.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 2.2610 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 1.6270 -1.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1840 1.5460 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 2.2500 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5870 1.5700 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6110 0.1870 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4280 -0.5300 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2060 0.1370 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9340 -0.6190 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8770 -0.0210 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9410 -1.9660 -1.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6470 -2.6280 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -2.6520 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -2.0380 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -0.6910 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -0.0580 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9010 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7630 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 3.1780 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 5.2180 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 3.6550 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 3.6670 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 5.2510 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 3.3300 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5150 2.1230 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5560 -0.3350 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4530 -1.6100 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -2.0840 -2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 -3.6500 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -3.6840 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 -2.0970 0.6390 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END