MDPI-ZINC03843405 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.6020 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 0.0710 -1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.0760 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6960 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -4.0850 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -4.8580 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -4.2400 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.8490 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -5.0610 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -6.2730 0.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -4.4650 1.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -5.3330 2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -4.7420 -3.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -6.0690 -3.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -6.6580 -4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -5.9210 -5.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -4.5940 -5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -4.0050 -4.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 -3.8290 -6.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -8.0350 -4.6090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -2.0970 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -5.9360 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.3700 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -5.9540 3.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -4.7260 3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -5.9700 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -4.2590 -7.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -2.8610 -6.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -8.5740 -3.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -8.4650 -5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END