MDPI-ZINC03845362 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.9140 1.5740 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 0.0490 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -0.6020 1.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4460 -0.3850 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -0.1180 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1890 -0.1280 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -0.6340 -0.8880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7730 -2.0950 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.0810 -1.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.0750 0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -3.8210 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -3.1600 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -2.9960 2.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -4.5100 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -5.5430 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -6.8030 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -7.0460 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -6.0280 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -4.7640 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -0.3550 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -0.4060 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 1.8510 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 1.9730 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 1.9830 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 0.8910 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -0.8060 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 0.8750 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -0.8220 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -5.3550 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -7.6030 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -8.0340 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -6.2240 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -3.9720 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 0.7160 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -0.8810 -2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.7010 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -0.0460 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -1.4950 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 0.0000 -0.0480 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 7 1 0 0 0 0 2 21 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 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END