MDPI-ZINC03849782 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 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 3 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 0.0170 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -0.4780 -0.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9160 -0.1020 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 0.0300 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7300 -1.5870 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 0.0130 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.5160 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 -0.0280 -1.2240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1610 1.0620 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4220 -1.6240 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -0.0110 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -0.6050 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -0.1520 0.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6100 -0.4910 -1.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1380 -0.0350 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 -2.0230 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -2.2880 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -1.0630 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6640 -0.8760 0.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 1.3300 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9100 -1.9070 -0.0360 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 0.2330 -0.1580 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 1.1070 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -0.3440 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 1.1200 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -0.3220 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 1.1030 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.3370 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1520 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -1.6060 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -0.3140 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 1.0760 1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -1.6930 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -0.2790 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -2.3450 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -2.5190 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -2.3720 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -3.2030 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 1.9300 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 1.6120 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 1.5020 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 -2.2980 0.7220 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 14 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 1 0 0 0 0 5 7 1 0 0 0 0 5 26 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 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 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 2 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 M END