MDPI-ZINC01719189 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.1340 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4940 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -1.8690 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -2.6270 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0080 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.7560 0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -2.5860 4.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -1.5490 6.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.3820 6.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.2270 7.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 0.8390 7.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.7640 6.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 1.6030 5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 0.5270 5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 0.3570 4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.4180 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 2.8180 5.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 3.7250 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 0.9840 7.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 1.2120 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -3.7050 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -2.9640 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -3.3470 4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -3.0730 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -1.4100 7.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -2.4620 6.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.9430 7.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 2.3170 4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 1.3230 3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -0.6000 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0050 0.1520 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 4.1610 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 3.1890 3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 4.5180 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 1.5110 8.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -1.6930 5.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 M END