MDPI-ZINC04267859 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 0 0 0 0 0 0999 V2000 11.9230 -3.0690 4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0720 -1.9730 3.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 -2.1690 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8520 -1.1430 3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 -1.3380 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 -2.5690 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8960 -3.5980 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 -3.3970 4.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -2.7820 4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -3.7910 3.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -1.8580 4.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 -0.5940 5.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -0.3960 6.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 -1.8320 6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -2.0850 5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -0.1400 8.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 1.3480 8.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 2.1220 7.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 3.4720 7.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 4.2820 6.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 5.6520 6.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 6.2290 7.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 5.4080 8.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 4.0400 8.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 7.6900 7.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 8.4620 7.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 7.8710 8.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 6.6910 8.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 8.6880 7.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 8.1090 7.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 8.8760 7.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 10.2180 7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 10.7980 7.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 10.0430 7.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6910 -3.9210 3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9640 -2.7800 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7630 -3.3430 5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2310 -0.1920 3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8090 -0.5400 3.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5220 -4.5510 4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9410 -4.1930 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 -0.6360 5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 0.2330 4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4500 -1.1660 7.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 0.5870 7.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -1.8880 6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -2.5850 7.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -1.3990 4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -3.1140 4.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -0.7290 8.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -0.3500 8.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0690 1.5990 9.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 1.5690 8.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 3.8360 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 6.2800 6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 5.8490 9.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 3.4060 9.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 8.1480 8.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 9.5300 7.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 7.0620 8.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 8.4300 7.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 10.8140 7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 11.8450 7.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 10.4980 7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -0.4940 6.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 65 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 65 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 65 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 59 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 33 2 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 M END