MDPI-ZINC04293072 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 76 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.3630 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.1560 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.6170 0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -1.9350 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -2.6790 0.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -2.4870 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 -4.0050 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -4.5650 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6250 -4.0720 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -4.3140 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -6.0690 -0.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5980 -6.5700 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 -6.6690 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -7.3790 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -7.6660 -2.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7250 -8.4280 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -6.3200 -1.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8720 -6.4680 -1.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4220 -5.5080 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -6.9100 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -8.2260 -3.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6640 -9.0030 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -8.1610 -3.3240 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8490 -9.2130 -3.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -7.4080 -4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -6.7480 -4.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -7.4870 -5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -7.5860 -5.7090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3860 -6.6130 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -8.6370 -4.6640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0240 -9.9740 -5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -10.4170 -6.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -9.3630 -7.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8570 -9.6440 -8.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -7.9620 -7.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -9.3830 -8.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -8.7830 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -7.4420 -0.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -5.1650 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 1.7090 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.8390 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 1.6230 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.4150 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -0.6320 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -2.2540 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -2.0380 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -4.2380 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -4.4540 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -4.8080 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -3.2420 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -4.7130 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 -7.3950 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 -5.8780 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -8.3160 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 -6.7370 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -6.1390 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -7.0330 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -8.3540 -6.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -6.5880 -6.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -10.7260 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -9.8720 -5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -10.6960 -6.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 -11.3260 -6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -7.2420 -7.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -7.8560 -7.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1090 -10.2270 -8.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -9.5450 -3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -9.0770 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -7.8310 -4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -7.5790 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3700 -4.2280 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -5.3230 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 -5.1210 -2.6490 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