MDPI-ZINC04265750 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -1.4410 11.5290 8.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 11.1010 9.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 9.9740 10.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 9.2600 9.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 9.6900 8.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 10.8340 8.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 8.9430 8.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 8.6950 7.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 8.9830 6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 8.9020 6.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 9.3830 4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 9.4770 4.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 9.8500 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 10.1320 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 10.0420 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 9.6610 3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 10.3450 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 10.2660 1.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 10.7280 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 10.5370 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 9.8190 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 8.4370 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8520 7.7710 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9770 8.4630 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9210 9.8270 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 10.5140 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 11.8530 0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 8.1530 10.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 12.4100 7.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 11.6540 9.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 9.6480 11.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 11.1710 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 8.5920 9.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 8.2770 6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 9.2580 5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 9.9220 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 10.4240 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 9.5860 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 11.1720 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 10.9120 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 7.8940 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 6.7050 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 7.9320 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 10.3580 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 12.3840 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 7.3330 10.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END