MDPI-ZINC04261465 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -1.3500 0.3300 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 0.0620 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 0.5620 0.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 1.2930 1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 0.5300 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 0.5060 2.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -0.7650 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.1770 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -1.0480 -3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.5100 -4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -1.3360 -6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7080 -5.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -3.2600 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -2.4380 -3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -2.9830 -2.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -2.2180 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -2.7420 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -4.4350 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 1.1610 -2.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 1.4060 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -0.0940 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -0.1270 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 2.2850 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 1.3880 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 1.0250 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.4920 2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 0.0370 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 0.5570 -5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -0.9190 -7.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -3.3490 -6.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -4.3290 -4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -4.8900 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -4.6580 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -4.8360 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 1.6320 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 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 27 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 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 M END