MDPI-ZINC03850376 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 -0.1360 1.5830 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 0.0770 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -0.4920 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -0.6370 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -2.1010 0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3220 -2.4340 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -2.6560 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -2.2570 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -3.0790 -3.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -2.7190 -4.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -1.5310 -4.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -0.7040 -3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -1.0740 -2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 0.4620 -4.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 1.2600 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -1.1750 -6.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -0.2950 -6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 0.0670 -5.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 0.2400 -7.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -2.6010 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -1.8140 2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 1.9820 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 1.9300 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 1.9270 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -0.1820 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -3.7430 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -2.2510 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -4.0050 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -3.3620 -5.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -0.4360 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 1.5400 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 2.1600 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 0.6890 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 1.1440 -7.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 0.4720 -8.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -0.5100 -8.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -3.9190 1.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -4.1920 2.6020 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 37 38 1 0 0 0 0 M END