MDPI-ZINC03846032 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.5240 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.0050 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -0.5590 1.2400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8480 0.1630 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -1.8350 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -1.4190 1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.5520 0.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7910 -1.4050 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 0.5880 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 0.7520 1.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -0.9090 0.7950 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7380 -0.0140 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -1.4550 1.9880 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5410 -2.3500 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -1.8000 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -3.0950 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 -3.4110 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -2.4330 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 -1.1380 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 -0.8210 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 -0.4650 3.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -1.8990 -0.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.4850 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.8980 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.9080 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.8570 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -2.6710 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -2.0810 2.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -2.2980 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -0.8360 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.2400 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -1.7880 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -0.7960 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -3.8590 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 -4.4230 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 -2.6800 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4570 -0.3740 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 0.1920 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5130 0.3600 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -2.7240 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -0.1240 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -1.5750 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0990 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 1.4200 -0.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 2.1360 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 44 45 1 0 0 0 0 M END