MDPI-ZINC03846863 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.0920 1.6840 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.1490 -0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8170 -0.3450 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 0.1770 2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -0.2220 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -0.8180 3.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 0.1460 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.3300 -0.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8750 0.1080 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -1.8480 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -2.3460 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -1.9110 -1.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0460 -2.2430 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.3810 -1.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1860 0.0100 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 0.0580 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.3180 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -1.5180 -3.3690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6360 -2.5100 -2.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5320 -2.8650 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -3.6920 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -3.7600 -4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -2.4400 -4.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2980 -2.6990 -3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 -3.6180 -4.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4450 -3.8740 -4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -4.9470 -3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9310 -5.1820 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 -4.3430 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 -3.2700 -3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 -3.0380 -4.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -1.8820 -5.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -1.0670 -4.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 2.0380 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 2.0290 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 2.0760 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -1.4350 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 0.0080 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.2820 3.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.2560 2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -0.3540 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.2200 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.3080 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -2.1380 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -3.4310 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -1.8980 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 1.1380 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -0.4350 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 0.5410 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -0.4730 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -4.6140 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -3.5210 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -4.6120 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -3.8410 -5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -1.7530 -3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 -3.1750 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -4.5640 -4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 -3.1420 -5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 -5.6020 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1030 -6.0200 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9640 -4.5260 -2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5720 -2.6140 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3200 -2.2020 -5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -2.4140 -6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.3350 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.9300 -4.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.6160 -3.5830 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 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 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 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 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 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 33 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 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 32 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 31 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