MDPI-ZINC03845288 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 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 3.6720 2.1820 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 2.4500 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 3.1990 -1.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9240 3.5500 -2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 3.2440 -3.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 4.2390 -2.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.1860 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.6890 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -4.1540 -1.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -4.8220 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -4.2090 -3.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -6.1700 -2.6490 N 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 3.3380 -0.4990 -0.0320 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 3.5340 3.1300 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 1.6010 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2350 1.5020 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 3.0310 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 3.4440 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5060 4.4840 -1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 4.4920 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -2.5390 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.5640 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.3350 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -2.3110 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -4.6430 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -6.6590 -1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -6.6510 -3.4920 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 M END