MDPI-ZINC03848616 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 0 0 0 0 0 0999 V2000 0.0870 1.3280 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -0.0870 -0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.5680 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 0.1900 2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -0.4480 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -1.8480 3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -2.6070 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -1.9630 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.7310 0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -2.5280 4.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -2.9130 5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -2.6060 5.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -3.7340 6.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -3.9170 6.7100 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0820 1.7840 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.5530 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.7560 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 1.2740 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 0.1580 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -3.6920 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -2.0840 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -3.4300 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -1.8660 4.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -4.1590 7.5450 O 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 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 24 2 0 0 0 0 M CHG 1 14 -1 M END