MDPI-ZINC03851067 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2060 -0.6760 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4410 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 2.2530 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 1.4290 0.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6490 1.1750 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 2.1940 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 1.5290 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2620 0.0580 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 -0.6180 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 0.1380 -0.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9920 0.3790 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 -0.6790 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -1.8720 0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.7560 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.1770 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 2.5740 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 3.1320 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 3.2730 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1970 2.0650 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1510 -0.4690 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -1.6970 0.1520 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 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 M END