MDPI-ZINC03846865 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.1740 1.5900 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 0.0580 0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9420 -0.4560 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 0.0540 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -0.2800 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -0.8180 3.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 0.0720 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.4680 0.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2390 -1.5640 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 -0.1020 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -0.7040 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -1.4270 -1.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3960 -2.1740 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.4190 -1.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9400 0.4730 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -1.0270 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -1.3380 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -1.5000 -3.4430 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6420 -2.1800 -2.9970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8700 -3.1910 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -2.3650 -4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -2.7370 -5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -2.4270 -4.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0240 -3.7130 -4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -4.5790 -5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 -5.8520 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -6.9650 -4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -8.1330 -4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -8.1880 -3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -7.0760 -4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -5.9090 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -1.7200 -5.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -0.1350 -4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 1.9480 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 1.9550 -0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.9580 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -1.5460 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.0950 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.4470 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 1.1250 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -0.4120 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 1.1450 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -0.5070 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 0.9780 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -1.4060 -2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 0.0970 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 -0.3240 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -1.9480 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -0.5070 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -2.2290 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -3.1850 -4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -1.4540 -4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -3.7970 -5.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -2.1380 -6.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -3.4710 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -4.2570 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -4.8210 -5.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -4.0350 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -6.9220 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -9.0020 -3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 -9.1000 -3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 -7.1190 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 -5.0420 -4.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -2.2430 -6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 0.3360 -4.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.2790 -5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 0.5030 -3.4020 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 32 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 M END