MDPI-ZINC03843659 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 -0.0080 1.3960 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.1290 -0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7800 -0.6530 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -0.6700 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 0.0300 -0.5180 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4080 1.1030 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -0.5300 -1.7040 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3040 -1.4760 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -0.8080 -1.3480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2810 -1.9070 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.3420 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -0.4280 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -0.5450 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6170 -1.5640 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 0.4270 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 0.0060 0.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 1.2360 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 2.1450 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 1.7420 0.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 0.4540 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 0.4700 -2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 0.6000 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 0.3540 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -0.0560 -0.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6650 -1.4570 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -1.8850 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 -0.8300 -2.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1430 -1.2150 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8330 0.4550 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 -0.5520 -1.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 0.9170 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 1.7290 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.7380 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.8100 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.0270 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.6720 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -0.1940 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -1.7140 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 0.6730 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -1.0250 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 0.4730 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -1.3070 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 1.0820 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 1.6470 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 1.9580 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 3.1960 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 0.9260 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 1.0220 2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -0.5650 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 0.0940 -3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 1.4370 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 0.9110 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -1.4660 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -2.1660 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0210 -2.8140 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -2.0730 -2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 0.5420 -3.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 1.3230 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 0.1120 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 0.6340 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 0.8800 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 1.9290 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 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 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 M END