MDPI-ZINC03850386 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 0.1110 1.3280 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 0.4350 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -0.2210 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.0180 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 0.9230 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 1.5700 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.6760 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 0.0230 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1530 -0.6750 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -2.0620 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4730 -2.6680 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6240 -1.9030 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5590 -0.5250 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3220 0.1060 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2090 1.5720 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 2.2490 -0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 2.1760 -0.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 1.4970 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 2.1030 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 1.8410 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 0.2520 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -0.9180 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 1.1130 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 2.2680 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 -1.7400 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -2.6620 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 -3.7450 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5830 -2.3910 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4620 0.0620 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 3.1450 -0.2470 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 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 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 M END