MDPI-ZINC04292945 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 64 0 0 1 0 0 0 0 0999 V2000 0.2130 0.7050 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.7740 1.4470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6870 -1.5980 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -1.2550 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -1.6410 1.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8110 -2.6980 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -0.8030 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -0.9910 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.3330 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -1.5620 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -0.7390 -0.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5650 0.3190 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -1.1230 1.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4760 -2.1920 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.3430 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -0.7810 2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -0.4300 0.6320 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2360 -0.9950 -0.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5290 -0.6000 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -2.4920 -0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -2.4650 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -3.4670 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 -4.7710 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -5.1050 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -6.3300 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 -7.2280 -1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 -6.9040 -1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -5.6860 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -1.2420 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 -0.8860 0.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 1.0740 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -1.3960 1.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 0.9740 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.3130 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 0.8810 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -1.3660 3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -2.6600 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -0.1840 2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 -1.8030 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 0.2490 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -1.1370 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.4570 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -1.2530 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -2.6200 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 -0.5550 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 0.7250 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -1.8580 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -0.2760 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -2.9780 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -2.9870 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0290 -3.3080 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -4.4060 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -6.5900 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -8.1850 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 -7.6100 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 -5.4360 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 1.5990 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 1.2760 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 1.4210 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -1.6180 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 32 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 42 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 13 1 0 0 0 0 11 18 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 45 1 0 0 0 0 15 46 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 29 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 60 1 0 0 0 0 M END