MDPI-ZINC03850093 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5210 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8070 -0.5720 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -0.5670 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 0.2510 -0.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3960 1.3070 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -0.1990 -1.6550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9070 0.6050 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -0.6010 -1.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4560 -1.7050 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -0.1420 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -0.2950 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -0.4720 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5360 -1.5060 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 0.3790 0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -1.4160 -2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -2.3440 -2.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -1.4860 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -1.0760 -1.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4240 -1.8180 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 0.2920 -0.6180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8430 0.7330 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 0.7580 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8650 -0.6360 0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5910 -1.3470 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2280 -1.0610 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 -0.6090 0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4830 1.3340 -1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 1.8990 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 1.8790 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 1.8750 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.0080 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.6060 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 -0.1750 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -1.6040 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 0.8930 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -0.7880 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.6060 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -1.1630 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 0.1460 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -2.5200 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -0.8530 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 1.7300 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 0.0360 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 1.4830 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8070 1.0420 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -2.0690 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5360 -0.3830 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7580 -0.3470 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 2.3110 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 1.3790 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 1.0530 -2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END