MDPI-ZINC03846008 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8190 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5620 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -2.3320 2.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -3.7840 2.5500 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6800 -4.2800 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -4.1520 4.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1890 -3.5930 4.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -5.7030 4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -6.2410 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -4.9640 2.9610 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8340 -4.3030 1.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5670 -5.0570 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 -3.2220 1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -3.9890 4.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 -2.5480 3.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -4.5220 5.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -5.1720 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.7390 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -6.0520 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -6.0130 3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -6.8540 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -6.8150 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -2.7580 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -1.8920 4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 -2.4870 3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -2.2380 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -5.5760 5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -4.4120 5.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -3.9580 6.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -5.8580 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -4.2150 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -5.5900 3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 M END