MDPI-ZINC03850331 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 0 0 0 0 0 0999 V2000 0.3900 0.4020 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.1840 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -1.5550 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -0.3350 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.7050 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -1.0360 -2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.4520 -2.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -3.1220 -2.1580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -0.0700 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -1.1060 1.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -0.8550 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 0.4270 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 1.4600 2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 1.2160 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 0.6710 4.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 2.0120 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 0.7370 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 0.3870 -1.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 0.5110 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 1.3780 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.2640 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -2.1800 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -2.0290 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -1.4310 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -0.7690 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.3510 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -0.9380 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -2.1030 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -1.6560 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 2.4560 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 2.0190 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 2.3110 5.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 2.6790 4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 2.0680 5.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -2.9670 -3.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 1.9480 -1.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 2.4740 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -3.8790 -4.0680 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 17 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 M END