MDPI-ZINC03850132 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.2380 -0.0110 1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 0.2530 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -0.4860 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -0.2460 -0.1290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6520 0.0030 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 0.4130 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 1.3560 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 1.9610 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8390 1.6220 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 0.6770 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 0.0700 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -1.7640 0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1900 -2.0580 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -2.1860 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -3.7130 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -4.2920 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -3.9480 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.4500 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -1.8180 -1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 1.7320 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 2.5050 1.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 0.2080 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 0.6270 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -1.0570 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -1.5390 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.3950 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -0.0510 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 1.6220 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 2.6980 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 2.0940 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 0.4130 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -0.6700 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -1.7770 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -1.8090 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -4.0930 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 -4.0130 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -5.3750 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -3.8650 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -4.4480 -0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -4.2700 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 2.1920 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 3.1390 -1.1750 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 4 1 0 0 0 0 2 20 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 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 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 41 42 1 0 0 0 0 M END