MDPI-ZINC04293414 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 1.0830 -0.5200 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.1000 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.7090 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -0.3470 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -0.9610 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -1.9510 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -2.3120 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -1.6880 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -2.6100 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0840 -1.8980 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0390 -0.4360 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 0.1370 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2660 0.3430 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5070 -0.3120 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6600 0.4110 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6080 1.7980 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 2.4600 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2010 1.7360 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0100 2.3770 0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6110 2.7980 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 3.8880 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0010 3.9680 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 2.7390 1.0630 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5690 -1.6630 0.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8580 -2.2660 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 0.0450 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -1.5830 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.3400 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.4180 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -0.6790 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -3.0750 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -1.9620 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 -3.6650 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0320 -2.4070 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6070 -0.1000 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 1.9300 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 3.4900 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 3.2960 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9750 4.7080 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 4.8850 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7670 -3.3460 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2740 -2.0320 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5180 -1.8780 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END