MDPI-ZINC03847240 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -0.7060 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -0.4820 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -0.7080 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -1.1610 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -1.3870 -2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -1.1640 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -1.3800 -3.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -1.1410 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.7180 -2.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 -1.3760 -1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 -1.8360 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -0.4910 1.0130 O 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 0.5290 -0.3650 0.8850 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 2.3970 -0.1330 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -1.7350 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -1.7280 -4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -1.3040 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -2.7890 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 -1.1040 -3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8280 -1.9680 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 -1.2640 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 M END