MDPI-ZINC03845873 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 -0.3330 1.3460 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.1570 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.6200 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -0.4440 1.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7920 0.1500 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -0.0750 2.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0860 -0.5210 3.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 0.0980 4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 1.6210 4.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6820 1.9360 4.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 2.0720 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 1.3130 2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 2.0300 4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 3.5440 3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 2.2550 6.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 1.7200 6.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.8590 2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.8330 1.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 1.8920 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 1.5750 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.6400 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.6930 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -0.0830 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.6900 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.4150 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -1.6100 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -0.2050 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.2330 5.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -0.2100 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 2.7710 4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 2.2520 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 1.0380 4.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.6190 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 3.8970 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 4.1560 4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -1.9280 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -0.6230 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -0.5850 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -2.4220 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 3.4140 6.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 3.7820 7.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 40 41 1 0 0 0 0 M END