MDPI-ZINC04712370 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.0580 1.5480 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 0.0600 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.4940 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -1.8560 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -2.6750 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -2.1100 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -0.7460 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -4.1350 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -4.6250 -0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -4.9240 -1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -6.3130 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -7.0020 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -6.2800 -3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -6.9020 -4.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -6.2190 -5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -4.9210 -5.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -4.2980 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -4.9700 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -7.0250 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -8.2220 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 1.7890 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 1.8730 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 2.0600 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 0.1410 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -2.2880 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.7380 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -0.3060 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -4.5270 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -8.0820 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -7.9150 -4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -6.6980 -6.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -4.3910 -6.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -3.2850 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -4.4850 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -6.3500 1.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -6.8620 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 35 36 1 0 0 0 0 M END