MDPI-ZINC03843988 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.0010 1.4810 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0430 0.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6980 -0.5760 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -0.1520 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -0.6420 0.2230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9300 -0.2800 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -0.1100 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.5740 -1.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7520 -1.6760 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.1760 -2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.7090 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -0.1190 -1.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9820 0.9820 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -0.5920 0.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3030 -1.6820 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.2170 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -1.0250 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -1.4220 -0.0750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5710 -0.3770 -1.1290 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0700 0.5870 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -0.9320 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -1.5030 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 -1.5330 -0.3540 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2760 -0.3660 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7420 -0.5360 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6200 -0.5290 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -2.7770 0.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -2.8110 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -2.0700 0.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.8480 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 1.8600 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.8230 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.1790 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -1.6650 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 0.9300 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.5950 2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 0.9740 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -0.5120 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.9050 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -0.6100 -3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.3910 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -1.7940 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.4250 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 0.8490 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -1.9330 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -0.4340 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -0.1240 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -1.7080 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -0.8560 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -2.5110 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 -0.3400 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 0.5670 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0670 -0.6640 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 -0.6520 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2950 -0.4010 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9320 -2.9120 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 -3.5170 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -3.1510 -1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -2.7480 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -2.4750 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 M END