MDPI-ZINC03843900 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7460 -0.5680 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -0.4430 2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.0530 2.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9790 -0.5720 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -0.5800 1.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4110 0.4960 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -0.5980 -0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9750 -0.0040 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -1.9980 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -1.7530 -1.7280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7120 -0.5460 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -2.9330 -1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -3.8740 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -1.4770 -3.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -1.2660 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -2.7510 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -3.3140 1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -2.5310 2.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7990 -2.7410 4.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -4.2290 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -4.9840 3.7400 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8660 -4.6030 3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -4.8100 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -6.3770 4.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -3.1940 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9090 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8930 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8830 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -1.5900 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 0.0150 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -0.8660 3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.6320 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -2.7090 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -2.3650 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 0.2220 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -0.8470 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -4.7160 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -2.2000 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 -0.8770 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -1.0390 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -3.3810 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.2520 4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -2.2880 4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -4.6840 4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -4.3390 5.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -5.2390 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 -5.2940 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -6.9190 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -2.7310 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -4.2560 2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -3.0670 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 3 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END