MDPI-ZINC03847902 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5210 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 0.8550 -0.5000 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 0.0470 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -0.2970 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9460 -0.8210 -0.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 0.0340 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.5110 -1.3000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6720 -1.6070 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -0.0880 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -0.6240 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -1.2490 -3.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -0.3670 -1.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1530 -1.1040 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -0.5980 0.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2270 -1.7100 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -0.2680 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 1.0940 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 1.3570 0.3130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9540 1.0230 -1.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2600 1.7970 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 0.9320 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3050 0.3380 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 0.5510 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 0.1550 1.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 2.8450 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.8990 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.8790 -0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 1.8740 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.1660 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -1.5900 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 1.1230 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -0.4240 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 1.1090 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.4420 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 0.9930 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.5170 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -1.0360 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.3340 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 1.1470 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 1.8890 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 1.9180 -2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 0.2670 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 0.8500 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -0.7280 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 3.4470 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 3.0570 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 3.0880 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 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 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END