MDPI-ZINC04701291 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 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 0.7170 -0.5920 1.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7760 -0.3540 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -2.1050 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -2.1220 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.6150 0.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6090 -0.1050 1.7800 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2550 -0.7850 2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.0740 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.2930 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 0.7790 4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -0.0370 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.9230 5.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 1.2120 1.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -0.3040 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.5560 -1.2980 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 1.0900 -2.5970 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -2.5880 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -2.6160 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -2.6170 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 0.2470 3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 1.8280 4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 0.6720 4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.5810 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -0.6830 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -0.7800 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 0.7750 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -0.1890 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -1.6450 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.2270 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 0.2190 6.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -0.3310 7.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 35 36 1 0 0 0 0 M END