MDPI-ZINC03843658 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 -0.0480 1.1860 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.3390 0.5640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0820 -0.7890 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.4610 2.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -1.2550 3.3110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4450 -2.3220 3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -0.8260 2.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9890 0.2210 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -0.9500 0.9160 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1100 -0.4930 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -2.4250 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -2.3480 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -1.0070 -0.7890 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0610 -0.3730 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -1.2530 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -1.8640 -2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 -2.7840 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -3.2970 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -2.1340 0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 0.0770 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 -1.6920 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -1.6420 4.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -1.3030 4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -0.9570 4.7480 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8380 0.5190 5.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 0.9620 6.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -0.1700 7.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6540 0.2240 8.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -1.2200 6.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -0.7350 7.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -1.7820 5.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 1.5710 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 1.4620 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 1.6100 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -1.8640 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -0.2750 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -0.7360 3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 0.6060 3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -2.9860 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -2.8730 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -3.1760 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -2.3770 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -3.6020 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -2.2650 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -4.1030 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 -3.6220 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 0.6110 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -0.1140 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 0.6820 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 -1.3180 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -2.7230 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -1.9040 4.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 0.6650 5.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 1.1170 4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 1.8120 6.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 1.2620 5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 -0.9570 6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -2.1750 6.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -1.3990 8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -1.1520 6.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -2.1650 6.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.6160 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 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 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 M END