MDPI-ZINC03845661 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0230 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7460 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.0410 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -4.1670 -1.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8690 -2.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.5200 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -3.2920 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -2.9460 -5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -1.8330 -6.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -1.0620 -5.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -1.4060 -3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -5.1790 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -5.1090 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -6.2650 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.1600 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -6.2300 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -5.0750 1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -4.1610 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -3.5460 -6.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -1.5640 -7.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -0.1930 -5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -0.8070 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -6.1270 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -4.1610 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -5.1840 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -6.2150 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -7.2120 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -5.2120 3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -6.9830 4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -6.1560 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -7.1780 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -5.1250 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -4.1270 2.0740 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 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END