MDPI-ZINC03845675 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.0970 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.5900 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -0.1960 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 0.9070 -5.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -1.0690 -5.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 0.9530 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -0.5050 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -0.8090 4.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -1.1800 5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -0.9260 7.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -1.2870 8.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -1.8970 8.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -2.1510 6.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -1.8010 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.8040 2.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.5830 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -0.5450 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.9880 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -0.1420 -3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -1.6760 -3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 1.1900 -6.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 1.5330 -5.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.7580 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.9740 -6.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.1080 -5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.4500 7.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.0910 9.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -2.1770 8.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -2.6270 6.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0030 4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -1.7680 2.4990 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 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 3 0 0 0 0 14 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 M END