MDPI-ZINC03845389 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.2310 1.4130 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.0820 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.6560 0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -1.9700 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -2.6180 0.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -2.6350 0.3680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2840 -1.9910 -0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -0.7960 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -0.2010 -1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -0.8060 -3.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -2.0050 -3.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -2.5930 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -2.6000 -4.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -1.9360 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 0.9740 -1.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -2.4790 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -1.5720 2.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -3.4270 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -3.6580 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -4.5480 3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8760 -5.2130 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 -4.9900 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -4.0980 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -4.0240 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 1.8440 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.9070 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 1.5540 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.2230 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -0.5760 2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -0.3250 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -0.3450 -4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -3.5240 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -1.8400 -5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -0.9450 -5.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -2.5160 -6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 1.7580 -1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -3.1400 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7990 -4.7270 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -5.9100 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7350 -5.5130 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -3.9220 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -4.4970 -0.2000 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 M END