MDPI-ZINC03850094 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 0.7170 -0.5250 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.0940 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -0.2460 -0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0160 -1.3270 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 0.1990 -1.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9370 1.2770 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.5260 -1.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9310 -1.6010 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.2340 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -0.3070 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.5520 -0.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4530 -1.6160 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.1730 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -0.1720 -2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -0.8260 -3.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 0.3060 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -0.0870 -1.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1530 -1.1720 -1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 0.4120 -0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0020 0.0610 1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 0.6980 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 0.1620 0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2700 -0.9220 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 0.5440 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4870 0.7460 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 1.9300 -0.1550 C 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 0.1730 -0.2280 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -1.6110 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 1.1770 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -0.2920 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.7610 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.9860 -3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 0.6330 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -1.1320 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -0.1340 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -0.1570 -3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 1.3900 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4380 0.4360 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -1.0220 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 1.7800 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9140 0.4480 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 0.1800 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 1.6290 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0080 0.5590 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 2.2960 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 2.3990 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 2.1760 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 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 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END