MDPI-ZINC03846673 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 0.2540 1.6760 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 0.2100 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.2190 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -1.5730 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.3500 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.0060 2.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -3.3890 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -0.6850 -1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -0.5320 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -1.3290 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -1.1750 -4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -0.2290 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 0.5660 -2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 0.4130 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 1.9000 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 1.9220 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 2.2670 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 0.4740 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -4.0000 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -3.6040 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 -3.6160 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -1.4270 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -2.0670 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -1.7940 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -0.1110 -4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 1.3040 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 1.0300 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 18 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 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 M END