MDPI-ZINC03843799 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.5330 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 0.0080 0.1860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6850 -0.5090 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -0.1850 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -0.8300 0.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6560 -1.9040 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -0.2180 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -0.4390 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -1.0140 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -1.3200 -2.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -0.3690 -1.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8160 0.6600 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.5300 0.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3160 -1.6050 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 0.0630 1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -0.5330 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -1.3330 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4950 -0.5870 -1.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9920 0.4060 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -1.4400 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 -1.8080 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5060 -1.4710 -0.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1080 -2.5660 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 -3.4410 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -0.2420 -0.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 -2.7540 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -0.5910 0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 1.9130 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.9060 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.8680 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.0480 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -1.5920 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 0.8910 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -0.5840 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 0.8470 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.7090 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -1.2880 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -1.1620 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -2.3520 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -0.0990 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 1.1480 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -1.1780 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 0.2800 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -0.8480 -3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -2.3300 -2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -1.2180 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -2.8710 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0200 -4.2240 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 -0.2680 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -3.2130 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -3.3420 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -2.7210 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -0.9740 -0.4760 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 8 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 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 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 17 26 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 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 3 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M END