MDPI-ZINC04293071 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 76 0 0 1 0 0 0 0 0999 V2000 -0.1960 0.9770 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.4160 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.8730 1.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -2.0870 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.7460 1.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -2.6270 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -4.0180 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -4.5660 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5890 -4.0670 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1650 -4.3110 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -6.0710 -0.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6000 -6.5620 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -6.6710 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -7.2780 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -7.5670 -2.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8850 -7.6620 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 -6.3330 -1.5590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8850 -6.5220 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4000 -6.5790 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -7.7970 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -8.9840 -1.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7700 -8.9860 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -8.8350 -1.4010 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0750 -8.7720 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -10.0470 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 -9.9290 -3.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -11.4140 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -11.4880 -1.5080 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9390 -11.4520 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -10.2960 -0.6560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4050 -10.3320 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -11.6390 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -12.8260 0.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2360 -13.7560 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -12.8020 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -12.7570 0.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -10.4060 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -5.3990 -0.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -5.1380 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 1.3200 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.6700 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 0.9350 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -0.3740 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -1.1090 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -2.6940 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -1.9600 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -3.9500 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -4.6850 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -4.8100 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -3.2390 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -4.7020 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -7.4490 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -5.8900 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 -8.2010 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -6.5620 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -7.9190 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -7.7390 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -11.5680 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -12.1810 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -9.4870 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -10.2730 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -11.6940 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -11.6680 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -13.6420 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -12.8550 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -12.7810 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -9.5690 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -11.3420 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -10.3840 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -5.4460 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -4.2610 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -5.3630 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -4.9400 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 49 1 0 0 0 0 10 50 1 0 0 0 0 10 51 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 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 37 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 M END