MDPI-ZINC03846445 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 1 0 0 0 0 0999 V2000 -0.3220 1.5950 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 0.0670 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -0.5280 1.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7540 -0.2420 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -2.0500 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -2.1080 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -0.5990 0.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5150 -0.1340 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 0.1370 2.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.0870 2.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1780 -0.7800 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 1.3360 2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 1.3490 3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 0.3270 3.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 -0.3070 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.4310 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 1.9940 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 1.9790 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9000 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -2.4830 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -2.5690 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.5760 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -2.6510 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 2.0020 1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 1.6720 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -0.6610 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 -0.8200 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 0.7660 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -0.0270 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -1.5200 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -0.1020 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 2.4980 3.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 2.4570 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 15 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 32 33 1 0 0 0 0 M END