MDPI-ZINC03846011 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 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 0 0 0 0 0 0 0 0 0 0 0.7810 -0.5890 1.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3650 -0.3670 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -2.0980 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -2.0990 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -0.5740 -1.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3380 -0.0250 -0.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4990 0.9910 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.0350 0.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3110 0.9760 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 -0.1830 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 -1.1350 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 -2.1280 1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -0.8770 -1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.2590 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -0.5880 -0.1160 C 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 1.7180 -2.5700 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -2.6090 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -2.5720 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.6110 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 0.6250 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 0.2340 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 -0.5720 2.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -1.6190 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5080 -2.7670 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -0.5840 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 0.8210 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.7040 -3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -0.6700 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -0.2570 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -1.6770 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.2480 0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -0.9190 1.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -1.3690 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 17 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 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 37 38 1 0 0 0 0 M END