MDPI-ZINC03843884 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5270 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 0.8390 -0.4310 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.3870 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -0.1090 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -0.6140 0.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4560 -0.2030 -0.6320 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9820 0.6770 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -1.3700 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4810 -1.1120 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -0.9780 -3.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1840 -1.8930 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -0.8100 -4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -0.5620 -5.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -1.2030 -6.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 0.5090 -5.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 0.2950 -4.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 0.2090 -3.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8230 0.1080 -1.9820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4000 1.1250 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -0.8350 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -0.5250 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 1.5110 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -2.0500 0.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.9040 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.8890 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.8780 0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.4390 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 0.2740 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -1.3380 2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 0.4150 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -0.7020 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 0.9420 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -2.2850 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -1.5100 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -1.9620 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -0.2170 -1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -1.7330 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 0.0070 -4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 0.4260 -6.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 1.4990 -5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -0.6340 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 1.1280 -4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -1.8680 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -0.6980 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 0.2210 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -1.4340 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 1.4680 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 2.3570 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 1.6320 -3.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -2.3800 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 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 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 M END