MDPI-ZINC03845927 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0470 1.2960 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -0.1770 0.9560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7890 -0.2740 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.8370 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -2.3390 1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -2.3450 1.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0920 -0.9700 0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -0.2410 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -1.1420 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -2.5520 2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -3.4370 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.9450 -0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -3.8880 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 -5.1900 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -5.6040 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -4.7360 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -3.4460 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -3.0190 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 1.8340 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.7290 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.3760 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -0.6690 2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.4660 3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.7870 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -2.8660 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 0.7060 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -0.8580 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -0.0530 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -1.8280 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -1.5460 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.1750 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -1.8110 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7630 -2.4410 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -3.5530 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -5.8680 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 -6.6090 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -5.0670 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -2.7750 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -2.0140 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 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 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 M END