MDPI-ZINC03851422 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5240 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.5140 1.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -1.5910 0.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3550 -2.4940 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.1400 0.9010 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3280 -1.4940 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -1.6750 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -1.5380 -1.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2890 -0.5020 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -2.4140 -1.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4910 -3.4250 -1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 -1.8180 -0.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2670 -2.4950 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.4940 -1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.4330 -2.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 -2.3630 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -2.1100 -2.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 -3.6920 -4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 -1.2230 -4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 0.3840 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 0.7670 1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -0.5480 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9020 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 -3.9070 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -3.6260 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -4.4910 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 -0.2780 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -1.1830 -4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -1.3960 -5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 0.7820 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 0.7810 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 1.7240 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -0.2020 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -1.6370 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.1910 0.8560 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 2 15 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END