MDPI-ZINC04262753 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0020 1.3980 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.0270 0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -0.6620 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 0.0710 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -0.5760 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -1.9540 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -2.6930 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -2.0510 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.7940 0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -4.0800 0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -4.7720 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -6.1850 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -7.3060 -0.5520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -4.0950 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -3.9040 1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -4.2130 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -3.2860 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -3.1080 2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7000 -2.8380 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -2.1930 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -1.7950 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 -2.0310 -2.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -2.6610 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -3.0780 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -3.7070 -1.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.7760 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.8170 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.6860 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 1.1470 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 -0.0030 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -2.4540 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -3.7690 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.3450 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -2.0070 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 -1.2950 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0960 -1.7100 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -2.8370 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 3 0 0 0 0 14 15 1 0 0 0 0 14 25 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 M END