MDPI-ZINC03848610 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.2240 2.5080 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 1.1100 0.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 0.2840 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 0.8240 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 0.0240 3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -1.3620 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -2.2330 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -3.5680 3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -4.0670 2.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -3.3160 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -1.9250 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -1.0780 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -1.5950 0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 -1.6970 5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -1.3070 4.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.0040 4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1520 0.3540 4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1620 -0.5910 4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 -1.8930 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 -2.2500 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -3.8840 5.4460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 2.8550 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 3.0510 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 2.6860 1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 1.8920 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 0.4580 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -4.2420 4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -3.7680 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -1.6640 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -0.8230 5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 -2.4650 6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 0.7340 4.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 1.3710 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1630 -0.3110 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6790 -2.6300 4.5910 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 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 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 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 M END