MDPI-ZINC04235198 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.1530 -0.0310 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 0.0680 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 0.6000 -0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 0.6130 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -0.2250 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 0.3470 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -0.4620 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 -1.8030 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -2.3130 -0.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -1.5720 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -0.4360 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 0.4500 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -0.1060 -3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 0.7390 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 0.2040 -6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -1.1710 -6.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -2.0210 -5.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -1.5000 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.3450 -3.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -1.8740 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -2.6550 -0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -3.7290 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -4.4980 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -5.8630 -2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -6.4630 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -5.7000 -4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -4.3360 -4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 1.7850 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.9360 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.0690 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.8400 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 1.6380 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 0.2050 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 1.3980 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -0.0500 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0670 -2.4410 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -2.0240 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 1.8100 -4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 0.8570 -6.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -1.5800 -7.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -3.0900 -5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -4.0300 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -6.4620 -2.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -7.5310 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -6.1720 -4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -3.7400 -4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 2.0400 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 11 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END