MDPI-ZINC03845601 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 0.6390 1.4490 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -0.0140 -0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -0.8120 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -0.5080 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.5200 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -2.8460 2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -3.1660 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.1540 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -2.1470 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.7900 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.4660 -2.4050 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.3910 -3.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -1.0170 -4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -1.9740 -5.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -3.3270 -5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -3.7290 -3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -2.7680 -2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -3.1470 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 0.9490 -2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 1.7660 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.8510 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 1.8190 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 0.5220 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 -1.2780 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -3.6300 3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -4.2000 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 0.0260 -4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -1.6800 -6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -4.0650 -5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -4.7800 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.1880 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 1.2900 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 1.0730 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 1.5360 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 M CHG 1 11 1 M END