MDPI-ZINC03846444 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 1 0 0 0 0 0999 V2000 0.4760 1.5520 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.0420 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.6210 1.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8640 -0.5400 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.1130 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 0.2720 1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.3180 0.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1170 -1.8250 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -2.6530 0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -2.1050 1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8600 -2.6160 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -2.8820 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -4.4060 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -4.8560 1.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 0.0490 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.5890 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 1.7260 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.9730 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 2.1480 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.4250 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 1.0930 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -0.2750 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 1.3260 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.6360 3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -2.6150 3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -0.4540 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -0.2520 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 1.1280 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.5480 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -1.6320 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -0.0460 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -5.0340 3.3230 O 0 5 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 M CHG 1 32 -1 M END