MDPI-ZINC03851165 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4270 -4.6390 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -4.8040 -0.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7110 -4.4350 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -6.3380 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -6.8810 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -6.0890 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 -6.6050 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -6.2900 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -4.8020 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -4.2910 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -4.7340 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -6.6600 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -6.7260 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -6.8560 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -7.9160 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -5.0280 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -6.2500 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 -6.1200 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -7.6830 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -6.5560 2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -6.8420 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 -4.1530 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -3.2120 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -4.4470 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 M END