MDPI-ZINC03845361 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.0390 1.3480 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.1660 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.6380 0.9500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9090 -0.5210 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 0.1610 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 0.1850 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -0.6230 0.3450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0470 -2.0660 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -3.0200 0.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -2.0750 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -5.0910 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -3.1580 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -4.3890 1.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -2.9820 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -1.9760 2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -1.8180 3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -2.6530 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -3.6520 1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -3.8260 1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -0.4220 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -0.9350 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 1.6420 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.6270 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 1.8550 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -0.3510 3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 1.1750 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -0.3160 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 1.2100 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -1.3230 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0410 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -2.5250 3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -4.3000 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 -4.6080 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -0.9850 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -0.7750 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 0.6370 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.6690 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -2.0060 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.6770 -2.3390 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 7 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END