MDPI-ZINC03845362 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -1.0830 1.1830 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -0.3030 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.6950 1.2250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2570 -0.6300 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 0.2310 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 0.2780 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -0.6460 -1.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7590 -2.0620 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -2.9820 -1.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -2.0920 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -5.0580 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -3.1600 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -4.3640 1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -2.9980 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -1.9300 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -1.7850 5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -2.6950 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -3.7560 5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -3.9100 3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.4760 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -1.1960 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 1.7820 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 1.4090 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 1.4160 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 1.2290 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -0.1980 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 1.2980 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -0.1280 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -1.2190 3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 -0.9600 5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.5770 6.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -4.4620 5.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -4.7350 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 0.5620 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -0.7430 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -1.1240 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -0.9820 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 -2.2430 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -1.0010 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 21 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 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M END