MDPI-ZINC03845451 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -0.1900 1.6520 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 0.1600 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.7540 1.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5650 -2.1370 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -2.0410 0.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 -2.3960 -0.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -2.9880 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -4.0730 -0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -2.3780 -2.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -0.8730 1.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -0.4830 3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -0.5920 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -1.0910 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -1.4820 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -1.3770 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -0.3020 -0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 2.0750 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 2.0940 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.8650 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -2.5100 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -2.8220 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -1.5110 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -2.8040 -3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -0.0930 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -0.2860 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0250 -1.1760 3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 -1.8720 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -1.6860 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.3440 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 16 2 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 M END