MDPI-ZINC03844014 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -1.4560 -0.2130 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.0960 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3520 -0.4200 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 1.6050 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 2.0560 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 3.5410 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 4.1750 -0.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 4.1610 -2.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 5.5930 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.3750 1.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8410 0.0730 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -1.9240 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.4280 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -1.2190 2.6280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5430 -1.1500 1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.0580 2.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5120 1.2730 2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 1.3130 3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 0.0600 4.7020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4930 -0.0020 5.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -1.2070 3.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7280 -1.2270 3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -2.4010 4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -2.4060 5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -1.2330 5.8790 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8730 -1.2680 4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 0.0740 5.8610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4080 1.2540 5.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 1.2180 6.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -0.1070 7.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -1.2880 7.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 0.1760 7.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.1900 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 0.2160 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 0.2170 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -1.2930 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 2.1270 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8360 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.5330 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 1.8240 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 6.0890 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 5.7980 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 5.9670 -3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -2.3240 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -2.2220 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -3.2850 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -2.6890 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 2.0580 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 1.5330 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 2.1820 4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 1.4620 3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -3.1680 4.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -3.1820 6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 2.1890 5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 1.2140 4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 1.3810 7.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 2.0300 6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -0.1220 7.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -0.2030 6.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -2.2210 7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -1.2670 8.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 1.0940 7.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 0.1900 8.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -0.6820 7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 0.4080 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 0.1630 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -1.2350 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 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 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 M END