MDPI-ZINC03846833 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 69 0 0 1 0 0 0 0 0999 V2000 0.1310 1.5770 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 0.0450 0.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8970 -0.4660 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 0.0420 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -0.2980 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -0.8390 3.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 0.0520 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.4840 0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2710 -1.5800 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.1220 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.7220 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -1.4400 -1.9390 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4170 -2.1880 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -0.4290 -1.2400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9120 0.4620 -1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -1.0410 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -1.3240 -2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -1.4780 -3.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6350 -2.1840 -3.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9040 -3.1860 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -2.4080 -4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -2.8060 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -2.4390 -4.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0690 -1.9250 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -3.6000 -4.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -4.1920 -4.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6150 -4.3260 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -5.5530 -4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -6.1550 -5.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 -5.1750 -5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2110 -3.8290 -5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 -3.3400 -4.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -0.1290 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 1.9390 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 1.9410 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 1.9420 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.5570 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -0.1060 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4550 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 1.1150 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -0.4360 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 1.1240 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -0.5370 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 0.9560 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -1.4270 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.0780 -3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.3530 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -1.9760 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -0.5010 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -2.2390 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -3.2280 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -1.5080 -4.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -3.8780 -5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.2510 -6.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -5.4260 -3.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 -6.2190 -4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -7.0980 -4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -6.3290 -6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0830 -5.0400 -4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4780 -5.5710 -5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0350 -3.1150 -5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 -3.9580 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 0.3340 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -0.2840 -5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 0.5220 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 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 41 1 0 0 0 0 7 42 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 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 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 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 33 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 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 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 31 62 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 M END