MDPI-ZINC03850352 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5940 -1.6950 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -0.8160 1.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8620 -0.0510 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7070 -0.6000 1.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 -0.4200 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 0.0580 -0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -2.2080 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -2.2550 3.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9860 -1.2760 3.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -3.3850 4.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8270 -3.3570 5.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -4.7030 6.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -5.5970 5.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -4.9330 7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 -6.1810 8.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 -6.3880 9.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 -5.3650 10.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9440 -4.1270 9.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -3.9060 8.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 0.3140 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 -1.3710 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -2.4200 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -2.9530 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -3.1270 5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 -2.5940 6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -6.9800 7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -7.3510 9.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 -5.5330 11.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 -3.3340 10.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 -2.9410 7.8090 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END