MDPI-ZINC03851665 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -0.1370 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -0.5830 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -1.3820 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -1.7360 -3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -1.2940 -2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -1.8670 -4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -1.4890 -4.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -3.3970 -4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -3.8880 -6.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -3.3620 -7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -1.8410 -7.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -1.3600 -5.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -3.8740 -8.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -4.1260 -9.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -4.2990 -10.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -4.5200 -11.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -4.5690 -10.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.3950 -9.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -4.1740 -8.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -3.9600 -7.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -4.7860 -11.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 -4.9560 -13.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 0.4880 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.3060 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -2.3600 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -1.5730 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -3.7580 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -3.7760 -4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -3.5240 -6.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -4.9770 -6.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -1.4380 -7.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.4970 -8.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -1.7450 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -0.2700 -5.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -3.1180 -8.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -4.7990 -8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -4.2610 -11.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.6550 -12.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -4.4320 -9.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -4.9110 -6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -3.2630 -6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -4.0600 -13.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -5.8150 -13.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -5.1200 -13.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 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 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 M END