MDPI-ZINC03846221 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.1070 1.2300 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1500 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.7700 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 -0.0100 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 1.3700 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 1.9900 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.6860 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -1.7200 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 0.3440 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 1.3150 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 2.2600 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 2.2340 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5570 1.2620 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 0.3150 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -1.3730 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -2.2620 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -2.8930 2.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -2.6340 3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2400 -1.7460 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -1.1190 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 1.7140 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.7440 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -1.8480 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 1.9640 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 3.0680 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -2.4120 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -1.2120 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -2.9630 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 1.3360 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 3.0200 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5490 2.9730 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 1.2420 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -0.4470 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -2.4640 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -3.5870 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 -3.1260 4.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1270 -1.5440 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 -0.4280 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 -2.4640 -1.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -3.0910 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 39 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 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 28 39 1 0 0 0 0 39 40 1 0 0 0 0 M END