MDPI-ZINC03845882 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.6910 1.7870 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 0.2730 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -0.0530 1.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0180 0.7130 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -0.0460 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -1.0240 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -0.6820 -1.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1890 -0.4340 -1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 0.5130 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 -1.8900 -2.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1950 -2.7440 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -1.5350 -3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -1.3390 -3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.9840 -5.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -2.1180 -6.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -2.3140 -6.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 -2.6690 -4.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -2.2200 -2.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.3920 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.3800 0.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.1160 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 2.1110 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 2.0220 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 2.3030 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 0.9590 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -0.3500 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -0.9570 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -2.0470 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 0.2150 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 0.8440 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 1.3280 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.6140 -4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.2600 -3.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -0.5320 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.8450 -5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -0.0630 -5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -3.0390 -5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -1.8650 -7.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -3.1210 -6.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -1.3930 -6.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -2.8080 -4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -3.5900 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -1.5040 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 0.2460 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -1.2010 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 0.3320 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -1.4870 2.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -2.3680 2.9940 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 8 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 19 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 9 1 0 0 0 0 7 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 47 48 1 0 0 0 0 M END