MDPI-ZINC01719201 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -4.1750 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -4.6900 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -5.0720 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -5.5280 3.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -5.6430 3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -5.2770 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -4.7800 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 -4.4010 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9120 -4.5070 2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -4.9890 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -5.3820 4.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 -5.8500 5.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8440 -5.0820 4.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 -4.6710 4.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -2.4290 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.9750 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -4.4960 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -4.5710 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -5.0020 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -6.0200 4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -4.0260 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 -4.2130 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -5.1620 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -4.7960 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0440 -3.6230 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3360 -5.2800 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 34 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 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END