MDPI-ZINC03845345 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -2.1330 1.4650 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0940 -0.0410 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 -0.6670 -1.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -2.0900 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.8080 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.1880 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -4.8630 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -4.1520 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -2.7570 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -4.8690 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -6.2120 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -6.9270 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -8.2890 0.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -8.9430 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 -8.5540 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 -9.7180 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6470 -9.6430 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2820 -8.4120 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -7.2560 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1590 -7.3060 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 -6.3600 0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 1.8100 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 1.8220 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 1.8540 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -0.1950 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -2.2850 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -4.7390 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -5.9410 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -2.2010 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -4.3170 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -6.7640 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -10.6780 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2350 -10.5480 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3600 -8.3690 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0620 -6.3040 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 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 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 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 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 M END